NP-MRD: Browsing natural products

Displaying natural products 281276 - 281300 of 281723 in total

NP-MRD ID
CAS Number Compound Name Species of Origin Chemical Structure Chemical Formula
Average Mass
Monoisotopic Mass NMR Spectra

NP0000726

884-33-3

(R)-2-Benzylsuccinate

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₁₁H₁₂O₄

208.2106 Da
208.07356 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 500 MHz, Ethanol, experimental)
¹³C NMR Spectrum (1D, 500 MHz, Ethanol, experimental)
¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 500 MHz, Ethanol, experimental)
¹H NMR Spectrum (1D, 600.133705802, CD₃OD, simulated)
¹H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 202 MHz, CD3OD, experimental)
[¹H , ¹H ]-COSY NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HMBC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HSQC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)

NP0000724

30344-00-4

Symmetric dimethylarginine

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Cannabis sativa
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₈H₁₈N₄O₂

202.2541 Da
202.14298 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)

NP0000723

513-86-0

Acetoin

Allium ampeloprasum
Allium cepa
Allium fistulosum
Aloe arborescens
Camellia sinensis
Capsicum annuum
Cocos nucifera
Coffea arabica
Coffea arabica L.
Coffea canephora
Corynebacterium glutamicum
Daphne odora
Daucus carota ssp. sativus
Ficus carica
Glycine max
Glycyrrhiza glabra
Helianthus annuus
Helianthus annuus L.
Litchi chinensis
Litsea cubeba
Malpighia emarginata
Mentha spicata
Plumeria rubra
Prunus persica
Rubus idaeus
Sergia lucens
Streptomyces avermitilis
Streptomyces virginiae
Theobroma cacao
Trifolium pratense
Vaccinium myrtillus
Vigna radiata
Vitis vinifera
Zea mays L.
(show all show less)

C₄H₈O₂

88.1051 Da
88.05243 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, simulated)
¹H NMR Spectrum (1D, 700 MHz, H₂O, simulated)
¹H NMR Spectrum (1D, 700 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 600 MHz, H₂O, simulated)
¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 600 MHz, H₂O, simulated)
¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000720

1492-27-9

Decanoylcarnitine

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Homo sapiens (Urine)
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₁₇H₃₃NO₄

315.4482 Da
315.24096 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)

NP0000719

79-06-1

Acrylamide

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Clinacanthus siamensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₃H₅NO

71.0779 Da
71.03711 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000718

300-85-6

3-Hydroxybutyric acid

Aloe africana
Anas platyrhynchos
Anatidae
Annulohypoxylon truncatum
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Cannabis sativa
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Cyphomandra betacea
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Homo sapiens
Homo sapiens (Serum)
Hydroclathrus clathratus
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Salmonella enterica
Secale cereale
Spondias mombin
Struthio camelus
Sus scrofa
Sus scrofa domestica
Triticum aestivum
Vitis rotundifolia
Vitis vinifera
(show all show less)

C₄H₈O₃

104.1045 Da
104.04734 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000717

63-38-7

Cytidine diphosphate

Abelmoschus esculentus
Actinidia chinensis
Agaricus bisporus
Agave
Allium ampeloprasum
Allium ascalonicum
Allium cepa
Allium fistulosum
Allium sativum
Allium schoenoprasum
Allium tuberosum
Allium cepa L.
Aloysia triphylla
Amaranthus
Amelanchier alnifolia
Anacardium occidentale
Ananas comosus
Anas platyrhynchos
Anatidae
Anethum graveolens
Angelica keiskei
Annona cherimola
Annona muricata
Annona reticulata
Annona squamosa
Anser anser
Anthriscus cerefolium
Apium graveolens
Apium graveolens var. dulce
Apium graveolens var. rapaceum
Apium graveolens var. secalinum
Arachis hypogaea
Arctium lappa
Armoracia rusticana
Artemisia dracunculus
Artemisia vulgaris
Artocarpus altilis
Artocarpus heterophyllus
Asparagus officinalis
Attalea speciosa
Auricularia auricula-judae
Auricularia polytricha
Avena sativa L.
Averrhoa carambola
Basella alba
Benincasa hispida
Bertholletia excelsa
Beta vulgaris
Beta vulgaris ssp. cicla
Bison bison
Borago officinalis
Bos taurus X Bison bison
Bos taurus
Brassica alboglabra
Brassica juncea
Brassica napus
Brassica oleracea
Brassica oleracea var. botrytis
Brassica oleracea var. capitata
Brassica oleracea var. gemmifera
Brassica oleracea var. gongylodes
Brassica oleracea var. italica
Brassica oleracea var. sabauda
Brassica oleracea var. viridis
Brassica rapa
Brassica rapa ssp. chinensis
Brassica rapa var. pekinensis
Brassica rapa var. rapa
Brassica ruvo
Brassica napus var. napus
Brosimum alicastrum
Bubalus bubalis
Byrsonima crassifolia
Cajanus cajan
Canarium ovatum
Cannabis sativa
Cantharellus cibarius
Capparis spinosa
Capra aegagrus hircus
Capsicum annuum
Capsicum annuum var. annuum
Capsicum chinense
Capsicum pubescens
Capsicum annuum L.
Carica papaya L.
Carissa macrocarpa
Carthamus tinctorius
Carum carvi
Carya
Carya illinoinensis
Castanea
Castanea crenata
Castanea mollissima
Castanea sativa
Ceratonia siliqua
Cervidae
Cervus canadensis
Chamaemelum nobile
Chamerion angustifolium
Chenopodium album
Chenopodium quinoa
Chrysanthemum coronarium
Cicer arietinum
Cichorium endivia
Cichorium intybus
Cinnamomum
Cinnamomum aromaticum
Cinnamomum verum
Cirsium
Citrullus lanatus
Citrus X sinensis (L.) Osbeck (pro. sp.)
Citrus aurantiifolia
Citrus latifolia
Citrus limon
Citrus maxima
Citrus paradisi
Citrus reticulata
Citrus ×limon (L.) Burm. f. (pro sp.)
Cocos nucifera
Coffea arabica L.
Coffea canephora
Colocasia esculenta
Columba
Columbidae
Corchorus olitorius
Coriandrum sativum L.
Corylus
Corylus avellana
Crateva religiosa
Crocus sativus
Cucumis melo
Cucumis metuliferus
Cucumis sativus L.
Cucurbita
Cucurbita maxima
Cucurbita moschata
Cuminum cyminum
Curcuma longa
Cydonia oblonga
Cymbopogon citratus
Cynara cardunculus
Cynara scolymus
Daucus carota
Daucus carota ssp. sativus
Dimocarpus longan
Dioscorea
Dioscorea pentaphylla
Diospyros
Diospyros kaki
Diospyros virginiana
Dromaius novaehollandiae
Durio zibethinus
Dysphania ambrosioides
Elaeis
Eleocharis dulcis
Elettaria cardamomum
Empetrum nigrum
Equus caballus
Eragrostis tef
Eriobotrya japonica
Eruca vesicaria subsp. Sativa
Eugenia javanica
Eugenia uniflora
Eutrema japonicum
Fagopyrum esculentum
Fagopyrum tataricum
Fagus
Feijoa sellowiana
Ficus carica
Flammulina velutipes
Foeniculum vulgare
Fragaria x ananassa
Gallus gallus
Garcinia mangostana
Gaylussacia baccata
Ginkgo biloba
Glycine max
Gossypium
Grifola frondosa
Hedysarum alpinum
Helianthus annuus L.
Helianthus tuberosus
Hibiscus sabbariffa
Hippophae rhamnoides
Hordeum vulgare
Hyssopus officinalis L.
Illicium verum
Ipomoea aquatica
Ipomoea batatas
Juglans
Juglans ailanthifolia
Juglans cinerea
Juglans nigra L.
Juglans regia
Lablab purpureus
Lactuca sativa
Lagenaria siceraria
Lagopus muta
Lathyrus sativus
Laurus nobilis L.
Lens culinaris
Lentinus edodes
Lepidium sativum
Leporidae
Lepus timidus
Levisticum officinale
Linum usitatissimum
Litchi chinensis
Luffa aegyptiaca
Lupinus
Lupinus albus
Macadamia
Macadamia tetraphylla
Malpighia emarginata
Malus
Malus pumila
Mammea americana
Mangifera indica
Manihot esculenta
Manilkara zapota
Maranta arundinacea
Matricaria recutita
Matteuccia struthiopteris
Medicago sativa
Melanitta fusca
Meleagris gallopavo
Melissa officinalis L.
Mentha
Mentha aquatica
Mentha arvensis
Mentha spicata
Mentha x piperita
Mespilus germanica
Metroxylon sagu
Momordica charantia
Morchellaceae
Morella rubra
Moringa oleifera
Morus
Morus nigra
Musa acuminata
Musa x paradisiaca
Mus musculus
Myrica
Myristica fragrans
Nelumbo
Nelumbo nucifera
Nephelium lappaceum
Numida meleagris
Nuphar lutea
Ocimum basilicum
Odocoileus
Oenothera biennis
Olea europaea
Opuntia
Opuntia cochenillifera
Opuntia macrorhiza
Origanum X majoricum
Origanum majorana
Origanum onites
Origanum vulgare
Oryctolagus
Oryza rufipogon
Oryza sativa
Ovis aries
Pachyrhizus erosus
Panax ginseng
Pangium edule
Panicum miliaceum
Passiflora edulis
Pastinaca sativa
Pediomelum esculentum
Perideridia oregana
Persea americana
Petasites japonicus
Petroselinum crispum
Phaseolus coccineus
Phaseolus lunatus
Phaseolus vulgaris
Phasianidae
Phasianus colchicus
Phoenix dactylifera
Photinia melanocarpa
Phyllostachys edulis
Physalis
Physalis philadelphica var. immaculata
Phytolacca americana
Pimenta dioica
Pimpinella anisum
Pinus
Pinus edulis
Piper nigrum L.
Pistacia vera
Pisum sativum
Pleurotus ostreatus
Polygonum alpinum
Portulaca oleracea
Pouteria sapota
Prunus armeniaca
Prunus avium
Prunus cerasus
Prunus domestica
Prunus dulcis
Prunus persica
Prunus persica var. nucipersica
Prunus persica var. persica
Prunus tomentosa
Prunus virginiana
Prunus avium L.
Psidium cattleianum
Psidium guajava
Psophocarpus tetragonolobus
Punica granatum
Pyrus communis
Pyrus pyrifolia
Quercus
Raphanus sativus
Raphanus sativus var. longipinnatus
Raphanus sativus var. sativus
Rheum rhabarbarum
Ribes aureum
Ribes glandulosum
Ribes nigrum
Ribes rubrum
Ribes uva-crispa
Rosa
Rubus arcticus
Rubus chamaemorus
Rubus idaeus
Rubus occidentalis
Rubus spectabilis
Rumex
Rumex acetosa
Rumex articus
Sagittaria latifolia
Salix pulchra
Salvia elegans
Salvia hispanica
Salvia officinalis
Salvia rosmarinus
Sambucus nigra
Sambucus nigra L.
Satureja hortensis L.
Satureja montana
Scorzonera hispanica
Secale cereale
Sechium edule
Sesamum indicum
Sesbania bispinosa
Sinapis alba
Sisymbrium
Solanum lycopersicum
Solanum lycopersicum var. cerasiforme
Solanum lycopersicum var. lycopersicum
Solanum melongena
Solanum quitoense
Solanum tuberosum
Sorbus aucuparia
Sorghum bicolor
Spinacia oleracea
Struthio camelus
Sus scrofa
Sus scrofa domestica
Syzygium aromaticum
Syzygium cumini
Syzygium jambos
Tamarindus indica
Taraxacum officinale
Tetragonia tetragonioides
Thelesperma
Thymus pulegioides
Thymus vulgaris
Tilia cordata
Tilia L.
Tragopogon porrifolius
Trigonella foenum-graecum
Triticum
Triticum aestivum
Triticum durum
Triticum spelta
Triticum turanicum
Typha angustifolia
Vaccinium
Vaccinium angustifolium
Vaccinium angustifolium X Vaccinium corymbosum
Vaccinium arboreum
Vaccinium corymbosum
Vaccinium deliciosum
Vaccinium elliottii
Vaccinium macrocarpon
Vaccinium myrtilloides
Vaccinium myrtillus
Vaccinium ovalifolium
Vaccinium ovatum
Vaccinium oxycoccos
Vaccinium parvifolium
Vaccinium reticulatum
Vaccinium stamineum
Vaccinium uliginosum
Vaccinium vitis-idaea
Valerianella locusta
Vanilla
Verbena officinalis
Viburnum edule
Vicia faba
Vigna aconitifolia
Vigna angularis
Vigna mungo
Vigna radiata
Vigna umbellata
Vigna unguiculata
Vigna unguiculata ssp. cylindrica
Vigna unguiculata ssp. unguiculata
Vigna unguiculata var. sesquipedalis
Vitis
Vitis aestivalis
Vitis labrusca
Vitis rotundifolia
Vitis vinifera L.
Xanthosoma sagittifolium
Zea mays L.
Zingiber officinale
Zizania
Zizania aquatica
Ziziphus zizyphus
(show all show less)

C₉H₁₅N₃O₁₁P₂

403.1764 Da
403.01818 Da

¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)

NP0000716

543-24-8

Acetylglycine

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Homo sapiens
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₄H₇NO₃

117.1033 Da
117.04259 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000715

672-15-1

L-Homoserine

Arabidopsis thaliana
Cannabis sativa
Chlamydomonas reinhardtii
Coffea arabica L.
Coffea canephora
Lathyrus latifolius
Lotus corniculatus
Lotus uliginosus
Pisum sativum
Salmonella enterica
Thalassiosira pseudonana
Trypanosoma brucei
(show all show less)

C₄H₉NO₃

119.1192 Da
119.05824 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, H₂O, simulated)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000714

123-78-4

Sphingosine

Glycine max
Laurencia nidifica
Mus musculus
Pogostemon cablin
Rehmannia glutinosa
Triticum aestivum
Tylopilus neofelleus
(show all show less)

C₁₈H₃₇NO₂

299.4919 Da
299.28243 Da

¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CD₃OD, experimental)

NP0000713

87-69-4

Tartaric acid

Allium cepa
Annona squamosa
Apium graveolens
Arabidopsis thaliana
Avena sativa L.
Averrhoa carambola
Capparis spinosa
Carica papaya L.
Cichorium intybus
Cissus quadrangularis
Coffea arabica L.
Coffea canephora
Cydonia oblonga
Daucus carota
Daucus carota ssp. sativus
Ficus carica
Foeniculum vulgare
Helianthus annuus L.
Hibiscus sabbariffa
Lactuca sativa
Mangifera indica
Morus indica
Musa x paradisiaca
Pelargonium spp.
Persea americana
Petroselinum crispum
Prunus armeniaca
Prunus cerasus
Prunus domestica
Punica granatum
Randia dumetorum
Ribes rubrum
Ribes uva-crispa
Rumex acetosa
Sapindus saponaria
Solanum lycopersicum var. lycopersicum
Solanum tuberosum
Tamarindus indica
Taraxacum officinale
Theobroma cacao
Vitis vinifera
Vitis vinifera L.
Xiphidium caeruleum
Zea mays L.
(show all show less)

C₄H₆O₆

150.0868 Da
150.01644 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 700 MHz, H₂O, simulated)
¹H NMR Spectrum (1D, 700 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000712

470-82-6

Eucalyptol

Achillea santolinoids
Aegle marmelos
Ageratina conyzoides
Ajania fruticulosa
Allium sativum
Alphinia galanga
Alpinia officinarum
Alpinia zerumbet
Amorpha fruticosa
Anemopsis californica
Anethum foeniculum
Anthemis aciphylla
Anthemis aciphylla BOISS.var.discoidea BOISS
Arabidopsis thaliana
Artemisia anethoides
Artemisia annua
Artemisia baldshuanica
Artemisia californica
Artemisia cana
Artemisia cana ssp.viscidula
Artemisia herba-alba
Artemisia maritima var. stechmannia
Artemisia taurica
Asarum heterotropoides var.mandsuricum
Asarum sieboldii
Backhousia angustifolia
Baeckea frutescens
Brassica hirta
Calamintha nepeta
Calycanthus floridus
Cananga odorata
Canarium album
Cannabis sativa
Centaurea atropurpurea
Centaurea orientalis
Chrysanthemum boreale
Cinnamomum augustifolium
Cinnamomum camphora
Cinnamomum camphorata
Cinnamomum fragrans
Cinnamomum illicioides
Cistus albidus
Citrus aurantifolia
Citrus aurantiifolia
Citrus limon
Citrus reticulata
Conyza newii
Coridothymus capitatus
Croton lechleri Mull.Arg.
Csitus ladaniferus
Cuminum cyminum
Cuminum cyminum L.
Curcuma aeruginosa
Curcuma amanda Roxb
Curcuma aromatica
Curcuma kwangsiensis
Curcuma longa
Curcuma mangga
Curcuma phaeocaulis
Curcuma wenyujin
Curcuma xanthorrhiza
Cymbopogon citratus
Cyperus rotundus
Cyperus rotundus L.
Eucalyptus alba
Eucalyptus bicostata
Eucalyptus camaldulensis
Eucalyptus cinerea
Eucalyptus cineria
Eucalyptus citriodara
Eucalyptus citriodora
Eucalyptus deglupta
Eucalyptus flocktoniae
Eucalyptus globulus
Eucalyptus grandis
Eucalyptus leucoxylon
Eucalyptus macathurii
Eucalyptus mackliana
Eucalyptus maideni
Eucalyptus maidenii
Eucalyptus microcorys
Eucalyptus mitchelliana
Eucalyptus nitens
Eucalyptus oblonga
Eucalyptus pellita
Eucalyptus radiata
Eucalyptus resinifera
Eucalyptus robusta
Eucalyptus saligna
Eucalyptus sideroxylon
Eucalyptus smithii
Eucalyptus spathulata
Eucalyptus tereticornis
Eucalyptus torelliana
Eucalyptus viminalis
Foeniculum vulgare
Hedychium coronarium
Helichrysum italicum
Hesperis matronalis
Isodon rubescens
Laurus nobilis
Laurus nobilis L.
Lavandula angustifolia
Lavandula dentata
Lavandula stoechas
Leptospermum scoparium
Lindera neesiana
Lippia javanica
Lippia ukambensis
Litsea pungens
Malva sylvestris
Matricaria discoidea
Matricaria matricarioides
Melaleuca alternifolia
Melaleuca leucadendra
Melaleuca leucadendron
Mentha arvensis
Mentha arvensis L.
Mentha piperita
Mentha piperita L.
Mentha pulegium
Mentha pulegium L.
Myrtus communis
Nicotiana alata
Nicotiana bonariensis
Nicotiana langsdorffii
Nicotiana mutabilis
Ocimum basilicum
Ocimum kilimandscharicim
Origanum vulgare
Perilla frutescens
Pinus halepensis
Pinus sibirica
Piper nigrum
Piper nigrum L.
Plectranthus marrubioides
Psidium guajava
Quercus coccifera
Rabdosia rubescens
Rosmarinus officinalis
Salvia leucophylla
Salvia officinalis
Salvia rosmarinus
Santolina corsica Jordan et Fourr
Sideritis chamaedrifolia
Sideritis tragoriganum
Sinapis alba
Tanacetum macrophyllum
Tanacetum vulgare
Tarchonanthus camphoratus
Tetradenia riparia
Thryptomene saxicola
Thymus X-porlock
Thymus eriocalyx
Thymus piperella
Thymus pubescens
Thymus vulgaris
Tipuana tipu
Verbena officinalis
Vitex trifolia
Xylopia aethiopica
Xylopia cayennensis
Xylopia parviflora
Zanthoxylum armatum
Zanthoxylum bungeanum
Zanthoxylum decaryi
Zingiber officinale
(show all show less)

C₁₀H₁₈O

154.2530 Da
154.13577 Da

¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CD₃OD, experimental)

NP0000710

6402-36-4

Traumatic acid

Meehania urticifolia

C₁₂H₂₀O₄

228.2848 Da
228.13616 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CD₃OD, experimental)

NP0000709

108-39-4

m-Cresol

Anas platyrhynchos
Anatidae
Anser anser
Artemisia capillaris
Artemisia dolosa
Asparagus officinalis
Azadirachta indica
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cedronella canariensis
Cervidae
Cervus canadensis
Coffea arabica
Coffea arabica L.
Columba
Columbidae
Daphne papyracea
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Ginkgo biloba
Homo sapiens
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Melia azadirach
Melia azedarach
Nicotiana bonariensis
Nicotiana cavicola
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Paeonia lactiflora
Paeonia suffruticosa
Penicillium solitum
Phasianidae
Phasianus colchicus
Pimpinella anisum
Pinus sibirica
Pueraria montana
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₇H₈O

108.1378 Da
108.05751 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000707

594-61-6

Alpha-Hydroxyisobutyric acid

Homo sapiens
Hyacinthoides non-scripta
Salmonella enterica

C₄H₈O₃

104.1045 Da
104.04734 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 600 MHz, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 201 MHz, CD₃OD, simulated)
¹³C NMR Spectrum (1D, 400 MHz, H₂O, simulated)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)
¹H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 202 MHz, CD3OD, experimental)
[¹H , ¹H ]-COSY NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HMBC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HSQC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)

NP0000706

98-98-6

Picolinic acid

Aloe africana
Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Homo sapiens
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Pyricularia oryzae
Russula subnigricans
Struthio camelus
Sus scrofa
Sus scrofa domestica
Trypanosoma brucei
(show all show less)

C₆H₅NO₂

123.1094 Da
123.03203 Da

¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000704

597-44-4

Citramalic acid

Ailuropoda melanoleuca
Aloe africana
Arabidopsis thaliana
Chlamydomonas reinhardtii
Citrus spp.
Curcuma domestica
Curcuma longa
Hylocereus undatus
Medicago sativa
Prunus cerasus
Salmonella enterica
(show all show less)

C₅H₈O₅

148.1140 Da
148.03717 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 400 MHz, H₂O, experimental)

NP0000703

80-59-1

Tiglic acid

Aloe africana
Anas platyrhynchos
Anatidae
Angelica archangelica
Angelica pubescens f.biserrata
Anser anser
Anthemis nobilis
Apis cerana
Apium graveolens
Apium graveolens var. dulce
Arctium lappa
Arnebia hispidissima
Azadirachta indica
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Chamaemelum nobile
Columba
Columbidae
Croton tiglium
Cuscuta chinensis
Daucus carota
Daucus carota ssp. sativus
Dromaius novaehollandiae
Equus caballus
Flavouring ingredient
Gallus gallus
Lagopus muta
Leporidae
Lepus timidus
Ligularia pleurocaulis
Lithospermum erythrorhizon
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Pelargonium graveolens
Petasites albus
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₅H₈O₂

100.1158 Da
100.05243 Da

¹H NMR Spectrum (1D, 500 MHz, 5%_DMSO, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000699

68-96-2

17-Hydroxyprogesterone

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Homo sapiens
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Mus musculus
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
Vitex agnus-castus
(show all show less)

C₂₁H₃₀O₃

330.4611 Da
330.21949 Da

¹H NMR Spectrum (1D, 500 MHz, CDCl₃, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl₃, experimental)

NP0000698

100-06-1

4'-Methoxyacetophenone

Abies nephrolepis
Anethum foeniculum
Cannabis sativa
Chuquiraga spinosa
Foeniculum vulgare
Mentha x piperita
Mitracarpus hirtus
Paeonia lactiflora
Photinia melanocarpa
Pimpinella anisum
Piper longum
Pulicaria paludosa
Scutellaria baicalensis
Solanum lycopersicum
Tanacetum sinaicum
Vaccinium oxycoccos
(show all show less)

C₉H₁₀O₂

150.1745 Da
150.06808 Da

¹H NMR Spectrum (1D, 90 MHz, CDCl₃, experimental)
¹³C NMR Spectrum (1D, 25 MHz, CDCl₃, experimental)
¹H NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 202 MHz, CD3OD, experimental)
[¹H , ¹H ]-COSY NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HMBC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)
[¹H , ¹³C ]-HSQC NMR Spectrum (1D, 601 MHz, CD3OD, experimental)

NP0000697

1509-34-8

L-Alloisoleucine

Anas platyrhynchos
Anatidae
Anser anser
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Capra aegagrus hircus
Cervidae
Cervus canadensis
Columba
Columbidae
Dromaius novaehollandiae
Equus caballus
Gallus gallus
Lagopus muta
Leporidae
Lepus timidus
Melanitta fusca
Meleagris gallopavo
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₆H₁₃NO₂

131.1729 Da
131.09463 Da

¹H NMR Spectrum (1D, 600 MHz, H₂O, experimental)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, H₂O, experimental)

NP0000695

6627-88-9

Methoxyeugenol

Asarum asperum
Cinnamomum glanduiferum
Cocculus orbiculatus
Illicium dunnianum
Illicium verum
Musa acuminata
Myristica fragrans
Pimenta racemosa
Piper aduncum
Piper auritum
Sassafras albidum
Spathiphyllum cannifolium
(show all show less)

C₁₁H₁₄O₃

194.2271 Da
194.09429 Da

¹H NMR Spectrum (1D, 400 MHz, CDCl₃, experimental)
¹³C NMR Spectrum (1D, 100 MHz, CDCl₃, experimental)
¹H NMR Spectrum (1D, 500.33, CDCl₃, simulated)
¹H NMR Spectrum (1D, 501 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 126 MHz, CDCl3, experimental)

NP0000694

463-40-1

Alpha-Linolenic acid

Abelmoschus esculentus
Abies pinsapo
Abramis brama
Abrus precatorius
Abutilon ramosum
Acacia polyacantha
Acanthopanax gracilistylus
Acipenseridae
Actinidia chinensis
Aegle marmelos
Aesculus hippocastanum
Agaricus bisporus
Agaricus blazei
Agave
Agave americana
Agave decipiens
Allamanda cathartica
Allium ampeloprasum
Allium ascalonicum
Allium cepa
Allium fistulosum
Allium hirtifolium
Allium obliquum
Allium sativum
Allium schoenoprasum
Allium tuberosum
Allium cepa L.
Aloe vera var.chinensis
Aloysia triphylla
Alpinia oxyphylla
Amaranthus
Amaranthus spinosus
Amaranthus tricolor
Amelanchier alnifolia
Anabaena flos-aquae
Anacardium occidentale
Ananas comosus
Anarhichas lupus
Anatidae
Anethum graveolens
Angelica keiskei
Anguilliformes
Annona cherimola
Annona muricata
Annona reticulata
Annona squamosa
Anthriscus cerefolium
Apios americana
Apium graveolens
Apium graveolens var. dulce
Apium graveolens var. rapaceum
Apium graveolens var. secalinum
Arabidopsis thaliana
Arachis hypogaea
Arctium lappa
Armoracia rusticana
Artemisia dracunculus
Artemisia vulgaris
Artocarpus altilis
Artocarpus heterophyllus
Asclepias syriaca
Asparagus officinalis
Astacidea
Astragalus danicus
Astragalus mongholicus
Attalea speciosa
Auricularia auricula-judae
Auricularia polytricha
Avena sativa L.
Averrhoa carambola
Azadirachta indica
Azima tetracantha
Basella alba
Bellis perennis
Belone belone
Benincasa hispida
Bertholletia excelsa
Beta vulgaris
Beta vulgaris ssp. cicla
Bidens pilosa
Boehmeria nivea
Borago officinalis
Bos taurus
Brachyura
Brassica alboglabra
Brassica juncea
Brassica napus
Brassica oleracea
Brassica oleracea var. botrytis
Brassica oleracea var. capitata
Brassica oleracea var. gemmifera
Brassica oleracea var. gongylodes
Brassica oleracea var. italica
Brassica oleracea var. sabauda
Brassica oleracea var. viridis
Brassica rapa
Brassica rapa ssp. chinensis
Brassica rapa var. pekinensis
Brassica rapa var. rapa
Brassica ruvo
Brassica napus var. napus
Brosimum alicastrum
Bryonia alba
Bupleurum chinense
Byrsonima crassifolia
Cajanus cajan
Calophyllum calaba
Calophyllum inophyllum
Camellia sinensis
Canarium ovatum
Canavalia ensiformis
Cannabis sativa
Cantharellus cibarius
Capparis spinosa
Capsicum annuum
Capsicum annuum var. annuum
Capsicum chinense
Capsicum pubescens
Capsicum annuum L.
Carica papaya
Carica papaya L.
Caridea
Carissa macrocarpa
Carthamus tinctorius
Carum carvi
Carya
Carya illinoinensis
Castanea
Castanea crenata
Castanea mollissima
Castanea sativa
Catharanthus roseus
Celastrus paniculata
Celosia cristada
Centaurea aspera
Ceratonia siliqua
Chamaecyparis formosensis
Chamaemelum nobile
Chamerion angustifolium
Chenopodium album
Chenopodium quinoa
Chlorella vulgaris
Chrysanthemum coronarium
Cicer arietinum
Cichlidae
Cichorium endivia
Cichorium intybus
Cinnamomum
Cinnamomum aromaticum
Cinnamomum verum
Cirsium
Citrullus lanatus
Citrus X sinensis (L.) Osbeck (pro. sp.)
Citrus aurantiifolia
Citrus latifolia
Citrus limon
Citrus maxima
Citrus paradisi
Citrus reticulata
Citrus ×limon (L.) Burm. f. (pro sp.)
Clitoria ternata
Clitoria ternatea
Clupeinae
Cocos nucifera
Coffea arabica L.
Coffea canephora
Colletia spinosissima
Colocasia esculenta
Columbidae
Consolida regalis
Corchorus aestuans
Corchorus olitorius
Coregonus
Coriandrum sativum L.
Corylus
Corylus avellana
Crataegus pinnatifida
Crateva religiosa
Crocus sativus
Crotalaria pallida
Croton cortesianus
Croton tiglium
Cryptomeria japonica
Cucumis melo
Cucumis metuliferus
Cucumis sativus
Cucumis sativus L.
Cucurbita
Cucurbita foetidissima
Cucurbita maxima
Cucurbita moschata
Cullen corylifolium
Cuminum cyminum
Cuphea epilobiifolia
Curcuma longa
Cuscuta pentagona
Cyclopteridae
Cydonia oblonga
Cymbopogon citratus
Cynara cardunculus
Cynara scolymus
Cystoclonium purpureum
Daucus carota
Daucus carota ssp. sativus
Dictamnus albus
Dimocarpus longan
Dioscorea
Dioscorea pentaphylla
Diospyros
Diospyros kaki
Diospyros virginiana
Dipteryx lacunifera
Dolichomitra cymbifolia
Drymaria cordata
Drypetes roxburghii
Durio zibethinus
Dysphania ambrosioides
Echinacea purpurea
Echium auberianum
Echium boissieri
Echium gentianoides
Echium giganteum
Echium lusitanicum
Echium pitardii
Echium plantagineum
Echium sabulicola
Echium strictum
Echium vulgare
Elaeagnus angustifolia
Elaeis
Elaeis guineensis
Eleocharis dulcis
Elettaria cardamomum
Elymus repens
Empetrum nigrum
Engraulidae
Epilobium parviflorum
Epimedium brevicornum
Eragrostis tef
Erigeron caucasicus
Eriobotrya japonica
Eruca vesicaria
Eruca vesicaria subsp. Sativa
Esox lucius
Eucheuma
Eugenia javanica
Eugenia uniflora
Euphausia superba
Euphorbia characias
Euphorbia glareosa
Eurhynchium striatum
Eutrema japonicum
Fagopyrum esculentum
Fagopyrum tataricum
Fagus
Feijoa sellowiana
Fernandoa adenophylla
Festuca rubra
Ficus carica
Fimbristylis quinquangularis
Flammulina velutipes
Foeniculum vulgare
Fragaria x ananassa
Gadiformes
Gadus
Gallus gallus
Garcinia mangostana
Garcinia xanthochymus
Gastropoda
Gaylussacia baccata
Ginkgo biloba
Gleditsia triacanthos
Glycine max
Gnetum edule
Gossypium
Gossypium hirsutum
Gracilaria gracilis
Grifola frondosa
Gymnanthemum myrianthum
Hedysarum alpinum
Helianthus annuus L.
Helianthus porteri
Helianthus tuberosus
Hibiscus cannabinus
Hibiscus sabbariffa
Hieracium intybaceum All.
Hippoglossus
Hippoglossus hippoglossus
Hippophae rhamnoides
Hirschfeldia incana
Homo sapiens
Hoplostethus atlanticus
Hordeum vulgare
Houttuynia cordata
Hoya latifolia
Hyoscyamus muticus
Hypericum perforatum
Hyssopus officinalis L.
Ictalurus punctatus
Illicium verum
Inezia integrifolia
Ipomoea aquatica
Ipomoea batatas
Isatis tinctoria
Jasminum auriculatum
Jodina rhombifolia
Juglans
Juglans ailanthifolia
Juglans cinerea
Juglans nigra L.
Juglans regia
Lablab purpureus
Lactarius deliciosus
Lactuca sativa
Lactuca serriola
Lagenaria siceraria
Lagopus muta
Lallemantia iberica
Lallemantia royleana
Lantana ukambensis
Larix gmelini
Lathraea squamaria
Lathyrus sativus
Laurus nobilis L.
Lemna aequinoctialis
Lens culinaris
Lentinus edodes
Lepidium meyenii
Lepidium meyenii Maca
Lepidium sativum
Leporidae
Leptolyngbya tenuis
Lepus timidus
Levisticum officinale
Ligularia macrophylla
Ligustrum lucidum
Limanda limanda
Linum usitatissimum
Litchi chinensis
Lota lota
Luffa acutangula
Luffa aegyptiaca
Lupinus
Lupinus albus
Lycium chinense
Macadamia
Macadamia tetraphylla
Macrococculus pomiferus
Malpighia emarginata
Malus
Malus pumila
Malva sylvestris
Mammea americana
Mangifera indica
Manihot esculenta
Manilkara zapota
Maranta arundinacea
Matricaria recutita
Matteuccia struthiopteris
Medicago sativa
Melanogrammus aeglefinus
Meleagris gallopavo
Melissa officinalis L.
Mentha
Mentha aquatica
Mentha arvensis
Mentha spicata
Mentha x piperita
Merlangius merlangus
Mespilus germanica
Metroxylon sagu
Micromesistius poutassou
Microstomus kitt
Mikania goyazensis
Molva molva
Momordica charantia
Morchellaceae
Morella rubra
Moringa oleifera
Morus
Morus nigra
Mosla chinensis
Mucuna puriens
Musa acuminata
Musa paradisiaca
Musa x paradisiaca
Mus musculus
Myrica
Myristica fragrans
Mytilidae
Nelumbo
Nelumbo nucifera
Neolitsea hiiranensis
Nepeta cataria
Nephelium lappaceum
Nephropidae
Nephrops norvegicus
Nervilia aragoana
Nicotiana tabacum
Nigella sativa
Nigella sativa L
Nonea macrosperma
Nuphar lutea
Nymphaea alba
Ocimum basilicum
Octopus vulgaris
Oecophylla smaragdina
Oenothera biennis
Olea europaea
Oleandra wallichii
Oncorhynchus gorbuscha
Oncorhynchus kisutch
Oncorhynchus mykiss
Oncorhynchus nerka
Ononis natrix
Ophiocordyceps sinensis
Opuntia
Opuntia cochenillifera
Opuntia macrorhiza
Origanum X majoricum
Origanum majorana
Origanum onites
Origanum vulgare
Oryza rufipogon
Oryza sativa
Ovis aries
Pachyrhizus erosus
Panax ginseng
Pangium edule
Panicum miliaceum
Papaver
Passiflora edulis
Pastinaca sativa
Pediomelum esculentum
Peperomia bracteata
Perciformes
Perideridia oregana
Perilla frutescens
Perilla frutescens var.arguta
Persea americana
Petasites japonicus
Petroselinum crispum
Phaseolus coccineus
Phaseolus lunatus
Phaseolus vulgaris
Phoenix dactylifera
Photinia melanocarpa
Phyllostachys edulis
Physalis
Physalis philadelphica var. immaculata
Phytolacca americana
Picea jezoensis
Picea obovata
Pimenta dioica
Pimpinella anisum
Pinus
Pinus edulis
Pinus resinosa
Pinus sibirica
Piper nigrum L.
Pistacia vera
Pisum sativum
Plagiochila porelloides
Plantago ovata
Platycodon grandiflorus
Pleuronectidae
Pleuronectiformes
Pleurotus ostreatus
Pollachius
Polygonum alpinum
Polypodium aureum
Pongamia pinnata
Populus tremula
Portulaca oleracea
Potentilla asiatica
Potentilla desertorum
Potentilla orientalis
Poterium polygamum
Pouteria sapota
Premna microphylla
Primula pulverulenta
Prunus armeniaca
Prunus avium
Prunus cerasus
Prunus domestica
Prunus dulcis
Prunus mume
Prunus persica
Prunus persica var. nucipersica
Prunus persica var. persica
Prunus tomentosa
Prunus virginiana
Prunus avium L.
Pseudostellaria heterophylla
Psidium cattleianum
Psidium guajava
Psophocarpus tetragonolobus
Psoralea corylifolia
Punica granatum
Pyrus communis
Pyrus pyrifolia
Quercus
Rana temporaria
Ranidae
Raphanus sativus
Raphanus sativus var. longipinnatus
Raphanus sativus var. sativus
Reinhardtius hippoglossoides
Rheum rhabarbarum
Rhodotorula glutinis
Ribes aureum
Ribes glandulosum
Ribes nigrum
Ribes rubrum
Ribes uva-crispa
Rosa
Rosa canina
Rosa platyacantha
Rosa taiwanensis
Rosa transmorrisonensis
Rubus arcticus
Rubus chamaemorus
Rubus idaeus
Rubus occidentalis
Rubus spectabilis
Rumex
Rumex acetosa
Rumex articus
Saccharina japonica
Sagittaria latifolia
Salix herbacea
Salix pulchra
Salmea scandens
Salmo salar
Salmonidae
Salvelinus
Salvelinus namaycush
Salvia elegans
Salvia fruticosa
Salvia hispanica
Salvia miltiorrhiza
Salvia officinalis
Salvia rosmarinus
Salvia trijuga
Sambucus nigra
Sambucus nigra L.
Sander lucioperca
Satureja hortensis L.
Satureja montana
Saussurea medusa
Schotia brachypetala
Scombridae
Scophthalmus maximus
Scorzonera hispanica
Scrophularia nodosa
Scurrula atropurpurea
Scurrura atropurpurea
Sebastes alutus
Sebastes viviparus
Secale cereale
Sechium edule
Senna alexandrina
Senna didymobotrya
Serenoa repens
Sesamum indicum
Sesbania bispinosa
Sideritis taurica
Siluriformes
Silybum marianum
Sinapis alba
Sisymbrium
Solanum lycopersicum
Solanum lycopersicum var. cerasiforme
Solanum lycopersicum var. lycopersicum
Solanum melongena
Solanum quitoense
Solanum tuberosum
Sorbus aucuparia
Sorghum bicolor
Spinacia oleracea
Squalus acanthias
Sterculia tragacantha
Stilpnopappus tomentosus
Stuckenia pectinata
Suaeda aegyptiaca
Sus scrofa domestica
Syzygium aromaticum
Syzygium cumini
Syzygium jambos
Talaromyces flavus
Tamarindus indica
Taonia atomaria
Taraxacum officinale
Taxus mairei
Tetragonia tetragonioides
Thalictrum revolutum
Thelesperma
Theobroma cacao
Thunnus
Thymus pulegioides
Thymus vulgaris
Tilia cordata
Tilia cordata Mill.
Tilia L.
Tragopogon porrifolius
Treculia africana
Trichosanthes kirilowii
Trichosanthes rosthornii
Trifolium alexandrinum
Trigonella foenum-graecum
Trisopterus esmarkii
Triticum
Triticum aestivum
Triticum durum
Triticum spelta
Triticum turanicum
Typha angustifolia
Typha domingensis
Typha domingensis P.
Ulva fasciata
Vaccinium
Vaccinium angustifolium
Vaccinium angustifolium X Vaccinium corymbosum
Vaccinium arboreum
Vaccinium corymbosum
Vaccinium deliciosum
Vaccinium elliottii
Vaccinium macrocarpon
Vaccinium myrtilloides
Vaccinium myrtillus
Vaccinium ovalifolium
Vaccinium ovatum
Vaccinium oxycoccos
Vaccinium parvifolium
Vaccinium reticulatum
Vaccinium stamineum
Vaccinium uliginosum
Vaccinium vitis-idaea
Valerianella locusta
Vanilla
Ventilago denticulata
Verbena officinalis
Viburnum edule
Vicia faba
Vigna aconitifolia
Vigna angularis
Vigna mungo
Vigna radiata
Vigna subterranea
Vigna umbellata
Vigna unguiculata
Vigna unguiculata ssp. cylindrica
Vigna unguiculata ssp. unguiculata
Vigna unguiculata var. sesquipedalis
Vitellaria paradoxa
Vitis
Vitis aestivalis
Vitis labrusca
Vitis rotundifolia
Vitis vinifera
Vitis vinifera L.
Wedelia calycina
Withania somnifera
Xanthosoma sagittifolium
Zea mays L.
Zingiber officinale
Zizania
Zizania aquatica
Ziziphus spina-christi
Ziziphus zizyphus
(show all show less)

C₁₈H₃₀O₂

278.4296 Da
278.22458 Da

¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl₃, experimental)

NP0000693

653-63-4

Deoxyadenosine monophosphate

Abelmoschus esculentus
Actinidia chinensis
Agaricus bisporus
Agave
Allium ampeloprasum
Allium ascalonicum
Allium cepa
Allium fistulosum
Allium sativum
Allium schoenoprasum
Allium tuberosum
Allium cepa L.
Aloysia triphylla
Amaranthus
Amelanchier alnifolia
Anacardium occidentale
Ananas comosus
Anas platyrhynchos
Anatidae
Anethum graveolens
Angelica keiskei
Annona cherimola
Annona muricata
Annona reticulata
Annona squamosa
Anser anser
Anthriscus cerefolium
Apium graveolens
Apium graveolens var. dulce
Apium graveolens var. rapaceum
Apium graveolens var. secalinum
Arachis hypogaea
Arctium lappa
Armoracia rusticana
Artemisia dracunculus
Artemisia vulgaris
Artocarpus altilis
Artocarpus heterophyllus
Asparagus officinalis
Attalea speciosa
Auricularia auricula-judae
Auricularia polytricha
Avena sativa L.
Averrhoa carambola
Basella alba
Benincasa hispida
Bertholletia excelsa
Beta vulgaris
Beta vulgaris ssp. cicla
Bison bison
Borago officinalis
Bos taurus X Bison bison
Bos taurus
Brassica alboglabra
Brassica juncea
Brassica napus
Brassica oleracea
Brassica oleracea var. botrytis
Brassica oleracea var. capitata
Brassica oleracea var. gemmifera
Brassica oleracea var. gongylodes
Brassica oleracea var. italica
Brassica oleracea var. sabauda
Brassica oleracea var. viridis
Brassica rapa
Brassica rapa ssp. chinensis
Brassica rapa var. pekinensis
Brassica rapa var. rapa
Brassica ruvo
Brassica napus var. napus
Brosimum alicastrum
Bubalus bubalis
Byrsonima crassifolia
Cajanus cajan
Canarium ovatum
Cannabis sativa
Cantharellus cibarius
Capparis spinosa
Capra aegagrus hircus
Capsicum annuum
Capsicum annuum var. annuum
Capsicum chinense
Capsicum pubescens
Capsicum annuum L.
Carica papaya L.
Carissa macrocarpa
Carthamus tinctorius
Carum carvi
Carya
Carya illinoinensis
Castanea
Castanea crenata
Castanea mollissima
Castanea sativa
Ceratonia siliqua
Cervidae
Cervus canadensis
Chamaemelum nobile
Chamerion angustifolium
Chenopodium album
Chenopodium quinoa
Chrysanthemum coronarium
Cicer arietinum
Cichorium endivia
Cichorium intybus
Cinnamomum
Cinnamomum aromaticum
Cinnamomum verum
Cirsium
Citrullus lanatus
Citrus X sinensis (L.) Osbeck (pro. sp.)
Citrus aurantiifolia
Citrus latifolia
Citrus limon
Citrus maxima
Citrus paradisi
Citrus reticulata
Citrus ×limon (L.) Burm. f. (pro sp.)
Cocos nucifera
Coffea arabica L.
Coffea canephora
Colocasia esculenta
Columba
Columbidae
Corchorus olitorius
Coriandrum sativum L.
Corylus
Corylus avellana
Crateva religiosa
Crocus sativus
Cucumis melo
Cucumis metuliferus
Cucumis sativus L.
Cucurbita
Cucurbita maxima
Cucurbita moschata
Cuminum cyminum
Curcuma longa
Cydonia oblonga
Cymbopogon citratus
Cynara cardunculus
Cynara scolymus
Daucus carota
Daucus carota ssp. sativus
Dimocarpus longan
Dioscorea
Dioscorea pentaphylla
Diospyros
Diospyros kaki
Diospyros virginiana
Dromaius novaehollandiae
Durio zibethinus
Dysphania ambrosioides
Elaeis
Eleocharis dulcis
Elettaria cardamomum
Empetrum nigrum
Equus caballus
Eragrostis tef
Eriobotrya japonica
Eruca vesicaria subsp. Sativa
Eugenia javanica
Eugenia uniflora
Eutrema japonicum
Fagopyrum esculentum
Fagopyrum tataricum
Fagus
Feijoa sellowiana
Ficus carica
Flammulina velutipes
Foeniculum vulgare
Fragaria x ananassa
Gallus gallus
Garcinia mangostana
Gaylussacia baccata
Ginkgo biloba
Glycine max
Gossypium
Grifola frondosa
Hedysarum alpinum
Helianthus annuus L.
Helianthus tuberosus
Hibiscus sabbariffa
Hippophae rhamnoides
Hordeum vulgare
Hyssopus officinalis L.
Illicium verum
Ipomoea aquatica
Ipomoea batatas
Juglans
Juglans ailanthifolia
Juglans cinerea
Juglans nigra L.
Juglans regia
Lablab purpureus
Lactuca sativa
Lagenaria siceraria
Lagopus muta
Lathyrus sativus
Laurus nobilis L.
Lens culinaris
Lentinus edodes
Lepidium sativum
Leporidae
Lepus timidus
Levisticum officinale
Linum usitatissimum
Litchi chinensis
Luffa aegyptiaca
Lupinus
Lupinus albus
Macadamia
Macadamia tetraphylla
Malpighia emarginata
Malus
Malus pumila
Mammea americana
Mangifera indica
Manihot esculenta
Manilkara zapota
Maranta arundinacea
Matricaria recutita
Matteuccia struthiopteris
Medicago sativa
Melanitta fusca
Meleagris gallopavo
Melissa officinalis L.
Mentha
Mentha aquatica
Mentha arvensis
Mentha spicata
Mentha x piperita
Mespilus germanica
Metroxylon sagu
Momordica charantia
Morchellaceae
Morella rubra
Moringa oleifera
Morus
Morus nigra
Musa acuminata
Musa x paradisiaca
Mus musculus
Myrica
Myristica fragrans
Nelumbo
Nelumbo nucifera
Nephelium lappaceum
Numida meleagris
Nuphar lutea
Ocimum basilicum
Odocoileus
Oenothera biennis
Olea europaea
Opuntia
Opuntia cochenillifera
Opuntia macrorhiza
Origanum X majoricum
Origanum majorana
Origanum onites
Origanum vulgare
Oryctolagus
Oryza rufipogon
Oryza sativa
Ovis aries
Pachyrhizus erosus
Panax ginseng
Pangium edule
Panicum miliaceum
Passiflora edulis
Pastinaca sativa
Pediomelum esculentum
Perideridia oregana
Persea americana
Petasites japonicus
Petroselinum crispum
Phaseolus coccineus
Phaseolus lunatus
Phaseolus vulgaris
Phasianidae
Phasianus colchicus
Phoenix dactylifera
Photinia melanocarpa
Phyllostachys edulis
Physalis
Physalis philadelphica var. immaculata
Phytolacca americana
Pimenta dioica
Pimpinella anisum
Pinus
Pinus edulis
Piper nigrum L.
Pistacia vera
Pisum sativum
Pleurotus ostreatus
Polygonum alpinum
Portulaca oleracea
Pouteria sapota
Prunus armeniaca
Prunus avium
Prunus cerasus
Prunus domestica
Prunus dulcis
Prunus persica
Prunus persica var. nucipersica
Prunus persica var. persica
Prunus tomentosa
Prunus virginiana
Prunus avium L.
Psidium cattleianum
Psidium guajava
Psophocarpus tetragonolobus
Punica granatum
Pyrus communis
Pyrus pyrifolia
Quercus
Raphanus sativus
Raphanus sativus var. longipinnatus
Raphanus sativus var. sativus
Rheum rhabarbarum
Ribes aureum
Ribes glandulosum
Ribes nigrum
Ribes rubrum
Ribes uva-crispa
Rosa
Rubus arcticus
Rubus chamaemorus
Rubus idaeus
Rubus occidentalis
Rubus spectabilis
Rumex
Rumex acetosa
Rumex articus
Sagittaria latifolia
Salix pulchra
Salvia elegans
Salvia hispanica
Salvia officinalis
Salvia rosmarinus
Sambucus nigra
Sambucus nigra L.
Satureja hortensis L.
Satureja montana
Scorzonera hispanica
Secale cereale
Sechium edule
Sesamum indicum
Sesbania bispinosa
Sinapis alba
Sisymbrium
Solanum lycopersicum
Solanum lycopersicum var. cerasiforme
Solanum lycopersicum var. lycopersicum
Solanum melongena
Solanum quitoense
Solanum tuberosum
Sorbus aucuparia
Sorghum bicolor
Spinacia oleracea
Struthio camelus
Sus scrofa
Sus scrofa domestica
Syzygium aromaticum
Syzygium cumini
Syzygium jambos
Tamarindus indica
Taraxacum officinale
Tetragonia tetragonioides
Thelesperma
Thymus pulegioides
Thymus vulgaris
Tilia cordata
Tilia L.
Tragopogon porrifolius
Trigonella foenum-graecum
Triticum
Triticum aestivum
Triticum durum
Triticum spelta
Triticum turanicum
Typha angustifolia
Vaccinium
Vaccinium angustifolium
Vaccinium angustifolium X Vaccinium corymbosum
Vaccinium arboreum
Vaccinium corymbosum
Vaccinium deliciosum
Vaccinium elliottii
Vaccinium macrocarpon
Vaccinium myrtilloides
Vaccinium myrtillus
Vaccinium ovalifolium
Vaccinium ovatum
Vaccinium oxycoccos
Vaccinium parvifolium
Vaccinium reticulatum
Vaccinium stamineum
Vaccinium uliginosum
Vaccinium vitis-idaea
Valerianella locusta
Vanilla
Verbena officinalis
Viburnum edule
Vicia faba
Vigna aconitifolia
Vigna angularis
Vigna mungo
Vigna radiata
Vigna umbellata
Vigna unguiculata
Vigna unguiculata ssp. cylindrica
Vigna unguiculata ssp. unguiculata
Vigna unguiculata var. sesquipedalis
Vitis
Vitis aestivalis
Vitis labrusca
Vitis rotundifolia
Vitis vinifera L.
Xanthosoma sagittifolium
Zea mays L.
Zingiber officinale
Zizania
Zizania aquatica
Ziziphus zizyphus
(show all show less)

C₁₀H₁₄N₅O₆P

331.2218 Da
331.06817 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, H₂O, simulated)
[¹H, ¹³C]-HSQC NMR Spectrum (2D, 400 MHz, H₂O, experimental)

NP0000691

149-32-6

Erythritol

Allium chinense
Anas platyrhynchos
Anatidae
Anethum graveolens
Annona squamosa
Anser anser
Arabidopsis thaliana
Aspergillus ochraceus
Bergera koenegii
Bison bison
Bos taurus X Bison bison
Bos taurus
Bubalus bubalis
Cajanus cajan
Cannabis sativa
Capra aegagrus hircus
Carum carvi
Carum carvi L.
Cervidae
Cervus canadensis
Citrus X sinensis (L.) Osbeck (pro. sp.)
Citrus sinensis
Cnidium monnieri
Columba
Columbidae
Curcuma domestica
Curcuma longa
Delonix regia
Dromaius novaehollandiae
Equus caballus
Euphorbia plumerioides
Foeniculum vulgare
Gallus gallus
Glehnia littoralis
Lagopus muta
Leporidae
Lepus timidus
Lotus corniculatus
Melanitta fusca
Meleagris gallopavo
Murraya paniculata
Numida meleagris
Odocoileus
Oryctolagus
Ovis aries
Phasianidae
Phasianus colchicus
Primula spp.
Ramalina usnea
Roccellaria mollis
Salacia chinensis
Solanum lycopersicum
Solanum lycopersicum L.
Struthio camelus
Sus scrofa
Sus scrofa domestica
(show all show less)

C₄H₁₀O₄

122.1198 Da
122.05791 Da

¹H NMR Spectrum (1D, 500 MHz, H₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹H NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)
¹³C NMR Spectrum (1D, 25 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 252 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 50 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 75 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 101 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 126 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 151 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 176 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 201 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 226 MHz, D₂O, predicted)
¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)
¹³C NMR Spectrum (1D, 400 MHz, D₂O, experimental)

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