NP0208320 | (2r)-2-(2-{[(5r,6r,7s,9s,11r,17r,18r,19s)-19-amino-6-{[(3r)-3,4-dicarboxybutanoyl]oxy}-11,17,18-trihydroxy-5,9-dimethylicosan-7-yl]oxy}-2-oxoethyl)butanedioic acid | | | C34H59NO15
721.8380 Da 721.38847 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0023691 | Iso-fumonisin B1 | | | C34H59NO15
721.8380 Da 721.38847 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) | 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) |
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NP0017060 | Fumonisin B1 | - Fusarium
- Fusarium verticillioides
| | C34H59NO15
721.8380 Da 721.38847 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) | 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) |
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NP0231444 | 2-[2-({19-amino-6-[(3,4-dicarboxybutanoyl)oxy]-11,17,18-trihydroxy-5,9-dimethylicosan-7-yl}oxy)-2-oxoethyl]butanedioic acid | | | C34H59NO15
721.8300 Da 721.38847 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0199666 | (6s,12s,15s,18s,23as)-12-benzyl-6-[(2s)-butan-2-yl]-1,4,7,10,13,16-hexahydroxy-18-(hydroxymethyl)-15-[(4-hydroxyphenyl)methyl]-3h,6h,9h,12h,15h,18h,21h,22h,23h,23ah-pyrrolo[1,2-a]1,4,7,10,13,16,19-heptaazacyclohenicosan-19-one | | | C36H47N7O9
721.8120 Da 721.34353 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0066986 | N1,N5,N10-Tris-(5-hydroxyferuloyl)spermidine | | | C37H43N3O12
721.7600 Da 721.28467 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) | 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) |
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NP0059550 | Acanthothamine | | | C34H43NO16
721.7090 Da 721.25818 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) | 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) |
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NP0243411 | [(1s,3r,17s,18r,19r,20r,21s,22s,23r,24r,25s)-19,21,24-tris(acetyloxy)-18,22,25-trihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-20-yl]methyl acetate | | | C34H43NO16
721.7090 Da 721.25818 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0069588 | Aquifoliunine E-II | | | C34H43NO16
721.7090 Da 721.25818 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) | 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) |
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NP0086101 | Tripterygiumine J | - Acanthothamnus aphyllus
- Tripterygium wilfordii
| | C34H43NO16
721.7090 Da 721.25818 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) | 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) |
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NP0159630 | [(1s,3s,13r,14r,17r,18r,19s,20r,21s,22r,23r,24r,25r)-19,21,24-tris(acetyloxy)-18,22,25-trihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-20-yl]methyl acetate | | | C34H43NO16
721.7090 Da 721.25818 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) | 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) |
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NP0281790 | [(1s,3r,13s,14r,17s,18r,19r,20r,21s,22s,23r,24s,25s)-18,19,21-tris(acetyloxy)-22,24,25-trihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-20-yl]methyl acetate | | | C34H43NO16
721.7090 Da 721.25818 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0166015 | [19,21,24-tris(acetyloxy)-18,22,25-trihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.0¹,²⁰.0³,²³.0⁷,¹²]pentacosa-7,9,11-trien-20-yl]methyl acetate | | | C34H43NO16
721.7023 Da 721.25818 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0008671 | Bravomicin A | - Micromonospora echinospora
| | C38H31N3O12
721.6750 Da 721.19077 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) | 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) |
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NP0198010 | 8-[(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-4-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium | | | C36H33O16
721.6430 Da 721.17631 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0045755 753008-65-0 | Catechin-(4alpha->8)-pelargonidin 3'-glucoside | | | C36H33O16
721.6376 Da 721.17686 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) | 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) |
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NP0234067 | 4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl icosanoate | | | C50H88O2
721.2520 Da 720.67843 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0233169 | 3a,5a,5b,8,8,11a-hexamethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl icosanoate | | | C50H88O2
721.2520 Da 720.67843 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0260774 | (3s,4ar,6ar,6bs,8ar,12as,14ar,14br)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl icosanoate | | | C50H88O2
721.2520 Da 720.67843 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0311918 | (1r,3ar,5ar,5br,7ar,9s,11ar,11br,13ar,13br)-3a,5a,5b,8,8,11a-hexamethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl icosanoate | | | C50H88O2
721.2520 Da 720.67843 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0248778 | (3r,3as,5ar,5br,7r,7ar,9s,11ar,11br,13ar,13bs)-7-hydroxy-5a,5b,11a,13b-tetramethyl-8-methylidene-3-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl icosanoate | | | C49H84O3
721.2080 Da 720.64205 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0213704 | 7-hydroxy-5a,5b,11a,13b-tetramethyl-8-methylidene-3-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysen-9-yl icosanoate | | | C49H84O3
721.2080 Da 720.64205 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0188210 | (3s,6e,10e,15s,19s,23s,27s,31s)-3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-1,6,10,34-tetraene-3,15,19,23,27,31-hexol | | | C45H84O6
721.1610 Da 720.62679 Da | 13C NMR Spectrum (1D, 25 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 100 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 252 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 1000 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 50 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 200 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 75 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 300 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 101 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 400 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 126 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 500 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 151 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 600 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 176 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 700 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 201 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 800 MHz, H2O, predicted) | 13C NMR Spectrum (1D, 226 MHz, H2O, predicted) | 1H NMR Spectrum (1D, 900 MHz, H2O, predicted) |
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NP0023611 | SCH 60057 | | | C45H84O6
721.1610 Da 720.62679 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) | 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) |
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NP0001836 | Hypsiziprenol-B9 | | | C45H84O6
721.1610 Da 720.62679 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) | 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) |
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