Showing NP-Card for Urodilatin (NP0136278)
| Record Information | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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| Version | 1.0 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Created at | 2022-05-12 15:10:23 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Updated at | 2022-05-12 15:10:23 UTC | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| NP-MRD ID | NP0136278 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Secondary Accession Numbers | None | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Natural Product Identification | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Common Name | Urodilatin | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Description | Urodilatin belongs to the class of organic compounds known as polypeptides. These are peptides containing ten or more amino acid residues. It is secreted in response to increased mean arterial pressure and increased blood volume from the cells of the distal tubule and collecting duct. Urodilatin is a very strong basic compound (based on its pKa). Urodilatin is a hormone that causes diuresis through increasing renal blood flow. It is important in oliguric patients (such as those with acute renal failure and chronic renal failure) as it lowers serum creatinine and increases urine output. | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Structure |  MOL for NP0136278 (Urodilatin)
57320831
Mrv1652304062013092D
244248 0 0 1 0 999 V2000
17.2570 -2.2282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
30.2749 -4.6924 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
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13.1101 8.3585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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17.2912 3.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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M END
3D MOL for NP0136278 (Urodilatin)
RDKit 3D
478482 0 0 0 0 0 0 0 0999 V2000
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M END
3D SDF for NP0136278 (Urodilatin)
57320831
Mrv1652304062013092D
244248 0 0 1 0 999 V2000
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68141 2 0 0 0 0
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70152 1 0 0 0 0
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71155 1 0 0 0 0
71162 1 0 0 0 0
72156 1 0 0 0 0
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160168 1 0 0 0 0
161162 1 0 0 0 0
161164 1 0 0 0 0
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170175 1 0 0 0 0
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172179 1 0 0 0 0
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242244 2 0 0 0 0
243244 1 0 0 0 0
M END
> <DATABASE_ID>
NP0136278
> <DATABASE_NAME>
NP-MRD
> <SMILES>
CCC(C)C1NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(O)=O)NC(=O)C(CCSC)NC(=O)C(CCCNC(N)=N)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CSSCC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)CNC1=O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(C)C)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(N)C(C)O
> <INCHI_IDENTIFIER>
InChI=1S/C145H234N52O44S3/c1-11-72(6)112-137(238)171-60-106(208)172-73(7)113(214)177-86(40-41-103(146)205)122(223)190-95(63-198)116(217)170-61-108(210)175-88(51-70(2)3)114(215)169-62-109(211)176-100(133(234)187-92(56-104(147)206)127(228)193-97(65-200)130(231)186-91(54-77-27-16-13-17-28-77)126(227)180-82(31-20-45-163-142(153)154)119(220)189-94(139(240)241)55-78-36-38-79(204)39-37-78)68-243-244-69-101(134(235)185-90(53-76-25-14-12-15-26-76)115(216)168-58-105(207)167-59-107(209)174-80(29-18-43-161-140(149)150)117(218)182-87(42-50-242-10)123(224)188-93(57-110(212)213)128(229)181-85(124(225)196-112)34-23-48-166-145(159)160)195-132(233)99(67-202)194-131(232)98(66-201)192-120(221)83(32-21-46-164-143(155)156)178-118(219)81(30-19-44-162-141(151)152)179-125(226)89(52-71(4)5)184-129(230)96(64-199)191-121(222)84(33-22-47-165-144(157)158)183-135(236)102-35-24-49-197(102)138(239)74(8)173-136(237)111(148)75(9)203/h12-17,25-28,36-39,70-75,80-102,111-112,198-204H,11,18-24,29-35,40-69,148H2,1-10H3,(H2,146,205)(H2,147,206)(H,167,207)(H,168,216)(H,169,215)(H,170,217)(H,171,238)(H,172,208)(H,173,237)(H,174,209)(H,175,210)(H,176,211)(H,177,214)(H,178,219)(H,179,226)(H,180,227)(H,181,229)(H,182,218)(H,183,236)(H,184,230)(H,185,235)(H,186,231)(H,187,234)(H,188,224)(H,189,220)(H,190,223)(H,191,222)(H,192,221)(H,193,228)(H,194,232)(H,195,233)(H,196,225)(H,212,213)(H,240,241)(H4,149,150,161)(H4,151,152,162)(H4,153,154,163)(H4,155,156,164)(H4,157,158,165)(H4,159,160,166)
> <INCHI_KEY>
IUCCYQIEZNQWRS-UHFFFAOYSA-N
> <FORMULA>
C145H234N52O44S3
> <MOLECULAR_WEIGHT>
3505.926
> <EXACT_MASS>
3503.683361186
> <JCHEM_ACCEPTOR_COUNT>
63
> <JCHEM_ATOM_COUNT>
478
> <JCHEM_AVERAGE_POLARIZABILITY>
357.84432252452626
> <JCHEM_BIOAVAILABILITY>
0
> <JCHEM_DONOR_COUNT>
60
> <JCHEM_FORMAL_CHARGE>
0
> <JCHEM_GHOSE_FILTER>
0
> <JCHEM_IUPAC>
2-[2-(2-{2-[2-({52-[2-(2-{2-[2-(2-{2-[2-({1-[2-(2-amino-3-hydroxybutanamido)propanoyl]pyrrolidin-2-yl}formamido)-5-carbamimidamidopentanamido]-3-hydroxypropanamido}-4-methylpentanamido)-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido}-3-hydroxypropanamido)-3-hydroxypropanamido]-49-benzyl-28-(butan-2-yl)-31,40-bis(3-carbamimidamidopropyl)-19-(2-carbamoylethyl)-34-(carboxymethyl)-16-(hydroxymethyl)-22-methyl-10-(2-methylpropyl)-37-[2-(methylsulfanyl)ethyl]-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51-hexadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazacyclotripentacontan-4-yl}formamido)-3-carbamoylpropanamido]-3-hydroxypropanamido}-3-phenylpropanamido)-5-carbamimidamidopentanamido]-3-(4-hydroxyphenyl)propanoic acid
> <ALOGPS_LOGP>
-0.94
> <JCHEM_LOGP>
-29.248052321907984
> <ALOGPS_LOGS>
-4.37
> <JCHEM_MDDR_LIKE_RULE>
1
> <JCHEM_NUMBER_OF_RINGS>
5
> <JCHEM_PHYSIOLOGICAL_CHARGE>
5
> <JCHEM_PKA>
3.7706689733216567
> <JCHEM_PKA_STRONGEST_ACIDIC>
3.133479322154005
> <JCHEM_PKA_STRONGEST_BASIC>
12.676141683684744
> <JCHEM_POLAR_SURFACE_AREA>
1593.119999999999
> <JCHEM_REFRACTIVITY>
930.4253000000009
> <JCHEM_ROTATABLE_BOND_COUNT>
82
> <JCHEM_RULE_OF_FIVE>
0
> <ALOGPS_SOLUBILITY>
1.50e-01 g/l
> <JCHEM_TRADITIONAL_IUPAC>
urodilatin
> <JCHEM_VEBER_RULE>
0
$$$$
PDB for NP0136278 (Urodilatin)HEADER PROTEIN 06-APR-20 NONE TITLE NULL COMPND MOLECULE: 57320831 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 06-APR-20 0 HETATM 1 S UNK 0 32.213 -4.159 0.000 0.00 0.00 S+0 HETATM 2 S UNK 0 56.513 -8.759 0.000 0.00 0.00 S+0 HETATM 3 S UNK 0 31.087 -5.210 0.000 0.00 0.00 S+0 HETATM 4 O UNK 0 22.628 22.415 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 21.516 24.193 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 23.796 16.986 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 17.144 27.616 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 18.872 31.901 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 24.472 15.603 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 29.265 17.944 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 32.830 13.687 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 28.713 9.961 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 32.277 5.703 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 32.953 4.320 0.000 0.00 0.00 O+0 HETATM 15 O UNK 0 28.160 1.978 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 34.305 1.552 0.000 0.00 0.00 O+0 HETATM 17 O UNK 0 52.640 -22.173 0.000 0.00 0.00 O+0 HETATM 18 O UNK 0 49.094 -25.899 0.000 0.00 0.00 O+0 HETATM 19 O UNK 0 31.724 -2.280 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 54.667 -17.446 0.000 0.00 0.00 O+0 HETATM 21 O UNK 0 54.921 -12.309 0.000 0.00 0.00 O+0 HETATM 22 O UNK 0 35.710 -0.446 0.000 0.00 0.00 O+0 HETATM 23 O UNK 0 44.473 -28.157 0.000 0.00 0.00 O+0 HETATM 24 O UNK 0 55.920 -13.262 0.000 0.00 0.00 O+0 HETATM 25 O UNK 0 53.370 -7.405 0.000 0.00 0.00 O+0 HETATM 26 O UNK 0 57.591 -15.341 0.000 0.00 0.00 O+0 HETATM 27 O UNK 0 39.355 -28.664 0.000 0.00 0.00 O+0 HETATM 28 O UNK 0 40.790 0.364 0.000 0.00 0.00 O+0 HETATM 29 O UNK 0 50.209 -3.348 0.000 0.00 0.00 O+0 HETATM 30 O UNK 0 34.380 -27.357 0.000 0.00 0.00 O+0 HETATM 31 O UNK 0 45.833 -0.645 0.000 0.00 0.00 O+0 HETATM 32 O UNK 0 15.496 -9.212 0.000 0.00 0.00 O+0 HETATM 33 O UNK 0 11.288 -5.362 0.000 0.00 0.00 O+0 HETATM 34 O UNK 0 27.912 -5.362 0.000 0.00 0.00 O+0 HETATM 35 O UNK 0 32.019 -26.983 0.000 0.00 0.00 O+0 HETATM 36 O UNK 0 25.999 -15.176 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 35.025 -30.916 0.000 0.00 0.00 O+0 HETATM 38 O UNK 0 30.172 -24.400 0.000 0.00 0.00 O+0 HETATM 39 O UNK 0 19.703 -5.362 0.000 0.00 0.00 O+0 HETATM 40 O UNK 0 26.557 -10.063 0.000 0.00 0.00 O+0 HETATM 41 O UNK 0 27.257 -20.163 0.000 0.00 0.00 O+0 HETATM 42 O UNK 0 23.911 -9.212 0.000 0.00 0.00 O+0 HETATM 43 O UNK 0 19.703 -9.982 0.000 0.00 0.00 O+0 HETATM 44 O UNK 0 5.747 -6.902 0.000 0.00 0.00 O+0 HETATM 45 O UNK 0 7.081 -9.212 0.000 0.00 0.00 O+0 HETATM 46 O UNK 0 22.577 -5.362 0.000 0.00 0.00 O+0 HETATM 47 O UNK 0 3.080 -2.282 0.000 0.00 0.00 O+0 HETATM 48 N UNK 0 19.415 22.549 0.000 0.00 0.00 N+0 HETATM 49 N UNK 0 22.444 19.754 0.000 0.00 0.00 N+0 HETATM 50 N UNK 0 19.618 26.619 0.000 0.00 0.00 N+0 HETATM 51 N UNK 0 26.193 18.157 0.000 0.00 0.00 N+0 HETATM 52 N UNK 0 24.349 24.969 0.000 0.00 0.00 N+0 HETATM 53 N UNK 0 20.770 29.475 0.000 0.00 0.00 N+0 HETATM 54 N UNK 0 29.081 15.283 0.000 0.00 0.00 N+0 HETATM 55 N UNK 0 30.433 12.516 0.000 0.00 0.00 N+0 HETATM 56 N UNK 0 24.533 27.630 0.000 0.00 0.00 N+0 HETATM 57 N UNK 0 26.746 26.140 0.000 0.00 0.00 N+0 HETATM 58 N UNK 0 30.925 8.471 0.000 0.00 0.00 N+0 HETATM 59 N UNK 0 35.903 13.474 0.000 0.00 0.00 N+0 HETATM 60 N UNK 0 29.880 4.533 0.000 0.00 0.00 N+0 HETATM 61 N UNK 0 25.456 7.513 0.000 0.00 0.00 N+0 HETATM 62 N UNK 0 38.299 14.645 0.000 0.00 0.00 N+0 HETATM 63 N UNK 0 38.115 11.984 0.000 0.00 0.00 N+0 HETATM 64 N UNK 0 30.372 0.488 0.000 0.00 0.00 N+0 HETATM 65 N UNK 0 50.432 -22.559 0.000 0.00 0.00 N+0 HETATM 66 N UNK 0 25.271 4.852 0.000 0.00 0.00 N+0 HETATM 67 N UNK 0 52.731 -18.577 0.000 0.00 0.00 N+0 HETATM 68 N UNK 0 27.668 6.023 0.000 0.00 0.00 N+0 HETATM 69 N UNK 0 46.890 -25.492 0.000 0.00 0.00 N+0 HETATM 70 N UNK 0 34.121 -1.109 0.000 0.00 0.00 N+0 HETATM 71 N UNK 0 53.500 -14.043 0.000 0.00 0.00 N+0 HETATM 72 N UNK 0 57.450 -19.676 0.000 0.00 0.00 N+0 HETATM 73 N UNK 0 52.642 -9.525 0.000 0.00 0.00 N+0 HETATM 74 N UNK 0 42.548 -27.007 0.000 0.00 0.00 N+0 HETATM 75 N UNK 0 37.700 -1.479 0.000 0.00 0.00 N+0 HETATM 76 N UNK 0 50.264 -5.589 0.000 0.00 0.00 N+0 HETATM 77 N UNK 0 37.951 -26.916 0.000 0.00 0.00 N+0 HETATM 78 N UNK 0 60.112 -19.518 0.000 0.00 0.00 N+0 HETATM 79 N UNK 0 58.918 -21.903 0.000 0.00 0.00 N+0 HETATM 80 N UNK 0 53.505 -1.988 0.000 0.00 0.00 N+0 HETATM 81 N UNK 0 42.294 -1.297 0.000 0.00 0.00 N+0 HETATM 82 N UNK 0 33.673 -25.230 0.000 0.00 0.00 N+0 HETATM 83 N UNK 0 46.665 -2.727 0.000 0.00 0.00 N+0 HETATM 84 N UNK 0 13.956 -6.902 0.000 0.00 0.00 N+0 HETATM 85 N UNK 0 28.556 -9.049 0.000 0.00 0.00 N+0 HETATM 86 N UNK 0 28.109 -18.090 0.000 0.00 0.00 N+0 HETATM 87 N UNK 0 18.163 -7.672 0.000 0.00 0.00 N+0 HETATM 88 N UNK 0 26.578 -7.672 0.000 0.00 0.00 N+0 HETATM 89 N UNK 0 9.748 -7.672 0.000 0.00 0.00 N+0 HETATM 90 N UNK 0 27.520 -13.529 0.000 0.00 0.00 N+0 HETATM 91 N UNK 0 22.371 -6.902 0.000 0.00 0.00 N+0 HETATM 92 N UNK 0 30.249 -22.160 0.000 0.00 0.00 N+0 HETATM 93 N UNK 0 9.955 -12.292 0.000 0.00 0.00 N+0 HETATM 94 N UNK 0 54.652 0.421 0.000 0.00 0.00 N+0 HETATM 95 N UNK 0 37.560 -31.745 0.000 0.00 0.00 N+0 HETATM 96 N UNK 0 56.164 -1.777 0.000 0.00 0.00 N+0 HETATM 97 N UNK 0 23.911 -3.052 0.000 0.00 0.00 N+0 HETATM 98 N UNK 0 8.621 -14.602 0.000 0.00 0.00 N+0 HETATM 99 N UNK 0 11.288 -14.602 0.000 0.00 0.00 N+0 HETATM 100 C UNK 0 20.232 21.244 0.000 0.00 0.00 C+0 HETATM 101 C UNK 0 19.243 20.063 0.000 0.00 0.00 C+0 HETATM 102 C UNK 0 17.814 20.639 0.000 0.00 0.00 C+0 HETATM 103 C UNK 0 17.921 22.176 0.000 0.00 0.00 C+0 HETATM 104 C UNK 0 21.768 21.137 0.000 0.00 0.00 C+0 HETATM 105 C UNK 0 19.991 23.978 0.000 0.00 0.00 C+0 HETATM 106 C UNK 0 19.042 25.190 0.000 0.00 0.00 C+0 HETATM 107 C UNK 0 23.980 19.647 0.000 0.00 0.00 C+0 HETATM 108 C UNK 0 24.841 20.925 0.000 0.00 0.00 C+0 HETATM 109 C UNK 0 17.517 24.975 0.000 0.00 0.00 C+0 HETATM 110 C UNK 0 24.656 18.263 0.000 0.00 0.00 C+0 HETATM 111 C UNK 0 24.165 22.308 0.000 0.00 0.00 C+0 HETATM 112 C UNK 0 18.669 27.831 0.000 0.00 0.00 C+0 HETATM 113 C UNK 0 25.025 23.586 0.000 0.00 0.00 C+0 HETATM 114 C UNK 0 19.245 29.260 0.000 0.00 0.00 C+0 HETATM 115 C UNK 0 26.869 16.773 0.000 0.00 0.00 C+0 HETATM 116 C UNK 0 18.296 30.473 0.000 0.00 0.00 C+0 HETATM 117 C UNK 0 26.008 15.496 0.000 0.00 0.00 C+0 HETATM 118 C UNK 0 28.405 16.667 0.000 0.00 0.00 C+0 HETATM 119 C UNK 0 16.771 30.258 0.000 0.00 0.00 C+0 HETATM 120 C UNK 0 30.618 15.177 0.000 0.00 0.00 C+0 HETATM 121 C UNK 0 31.478 16.454 0.000 0.00 0.00 C+0 HETATM 122 C UNK 0 25.210 26.246 0.000 0.00 0.00 C+0 HETATM 123 C UNK 0 33.014 16.348 0.000 0.00 0.00 C+0 HETATM 124 C UNK 0 31.294 13.793 0.000 0.00 0.00 C+0 HETATM 125 C UNK 0 33.875 17.625 0.000 0.00 0.00 C+0 HETATM 126 C UNK 0 33.690 14.964 0.000 0.00 0.00 C+0 HETATM 127 C UNK 0 31.109 11.132 0.000 0.00 0.00 C+0 HETATM 128 C UNK 0 32.646 11.025 0.000 0.00 0.00 C+0 HETATM 129 C UNK 0 30.249 9.855 0.000 0.00 0.00 C+0 HETATM 130 C UNK 0 33.506 12.303 0.000 0.00 0.00 C+0 HETATM 131 C UNK 0 30.065 7.194 0.000 0.00 0.00 C+0 HETATM 132 C UNK 0 35.042 12.196 0.000 0.00 0.00 C+0 HETATM 133 C UNK 0 28.528 7.300 0.000 0.00 0.00 C+0 HETATM 134 C UNK 0 27.852 8.684 0.000 0.00 0.00 C+0 HETATM 135 C UNK 0 30.741 5.810 0.000 0.00 0.00 C+0 HETATM 136 C UNK 0 26.316 8.790 0.000 0.00 0.00 C+0 HETATM 137 C UNK 0 30.556 3.149 0.000 0.00 0.00 C+0 HETATM 138 C UNK 0 37.439 13.367 0.000 0.00 0.00 C+0 HETATM 139 C UNK 0 32.093 3.042 0.000 0.00 0.00 C+0 HETATM 140 C UNK 0 29.696 1.872 0.000 0.00 0.00 C+0 HETATM 141 C UNK 0 26.131 6.129 0.000 0.00 0.00 C+0 HETATM 142 C UNK 0 50.421 -24.801 0.000 0.00 0.00 C+0 HETATM 143 C UNK 0 49.370 -23.675 0.000 0.00 0.00 C+0 HETATM 144 C UNK 0 31.908 0.382 0.000 0.00 0.00 C+0 HETATM 145 C UNK 0 51.921 -24.454 0.000 0.00 0.00 C+0 HETATM 146 C UNK 0 52.124 -19.992 0.000 0.00 0.00 C+0 HETATM 147 C UNK 0 50.338 -26.273 0.000 0.00 0.00 C+0 HETATM 148 C UNK 0 53.501 -20.682 0.000 0.00 0.00 C+0 HETATM 149 C UNK 0 51.354 -21.326 0.000 0.00 0.00 C+0 HETATM 150 C UNK 0 48.184 -24.657 0.000 0.00 0.00 C+0 HETATM 151 C UNK 0 32.769 1.659 0.000 0.00 0.00 C+0 HETATM 152 C UNK 0 32.584 -1.002 0.000 0.00 0.00 C+0 HETATM 153 C UNK 0 54.787 -19.834 0.000 0.00 0.00 C+0 HETATM 154 C UNK 0 52.972 -25.579 0.000 0.00 0.00 C+0 HETATM 155 C UNK 0 53.424 -15.581 0.000 0.00 0.00 C+0 HETATM 156 C UNK 0 56.164 -20.524 0.000 0.00 0.00 C+0 HETATM 157 C UNK 0 53.166 -17.099 0.000 0.00 0.00 C+0 HETATM 158 C UNK 0 34.797 -2.492 0.000 0.00 0.00 C+0 HETATM 159 C UNK 0 45.506 -26.167 0.000 0.00 0.00 C+0 HETATM 160 C UNK 0 54.955 -15.748 0.000 0.00 0.00 C+0 HETATM 161 C UNK 0 53.106 -10.994 0.000 0.00 0.00 C+0 HETATM 162 C UNK 0 53.393 -12.506 0.000 0.00 0.00 C+0 HETATM 163 C UNK 0 33.455 -3.249 0.000 0.00 0.00 C+0 HETATM 164 C UNK 0 54.599 -10.617 0.000 0.00 0.00 C+0 HETATM 165 C UNK 0 36.218 -1.900 0.000 0.00 0.00 C+0 HETATM 166 C UNK 0 44.052 -26.675 0.000 0.00 0.00 C+0 HETATM 167 C UNK 0 51.211 -6.804 0.000 0.00 0.00 C+0 HETATM 168 C UNK 0 56.155 -14.783 0.000 0.00 0.00 C+0 HETATM 169 C UNK 0 52.007 -8.122 0.000 0.00 0.00 C+0 HETATM 170 C UNK 0 52.479 -5.931 0.000 0.00 0.00 C+0 HETATM 171 C UNK 0 55.020 -9.135 0.000 0.00 0.00 C+0 HETATM 172 C UNK 0 41.016 -27.159 0.000 0.00 0.00 C+0 HETATM 173 C UNK 0 58.827 -20.366 0.000 0.00 0.00 C+0 HETATM 174 C UNK 0 39.220 -1.236 0.000 0.00 0.00 C+0 HETATM 175 C UNK 0 52.358 -4.396 0.000 0.00 0.00 C+0 HETATM 176 C UNK 0 39.068 0.296 0.000 0.00 0.00 C+0 HETATM 177 C UNK 0 53.627 -3.523 0.000 0.00 0.00 C+0 HETATM 178 C UNK 0 39.476 -27.129 0.000 0.00 0.00 C+0 HETATM 179 C UNK 0 41.077 -28.698 0.000 0.00 0.00 C+0 HETATM 180 C UNK 0 36.461 -26.525 0.000 0.00 0.00 C+0 HETATM 181 C UNK 0 40.759 -1.176 0.000 0.00 0.00 C+0 HETATM 182 C UNK 0 49.181 -4.495 0.000 0.00 0.00 C+0 HETATM 183 C UNK 0 35.983 -27.989 0.000 0.00 0.00 C+0 HETATM 184 C UNK 0 40.320 1.194 0.000 0.00 0.00 C+0 HETATM 185 C UNK 0 47.975 -3.536 0.000 0.00 0.00 C+0 HETATM 186 C UNK 0 35.029 -25.960 0.000 0.00 0.00 C+0 HETATM 187 C UNK 0 30.093 -6.386 0.000 0.00 0.00 C+0 HETATM 188 C UNK 0 37.011 -29.135 0.000 0.00 0.00 C+0 HETATM 189 C UNK 0 29.246 -7.672 0.000 0.00 0.00 C+0 HETATM 190 C UNK 0 12.622 -7.672 0.000 0.00 0.00 C+0 HETATM 191 C UNK 0 56.934 -7.278 0.000 0.00 0.00 C+0 HETATM 192 C UNK 0 26.220 -16.884 0.000 0.00 0.00 C+0 HETATM 193 C UNK 0 27.733 -16.597 0.000 0.00 0.00 C+0 HETATM 194 C UNK 0 25.353 -18.157 0.000 0.00 0.00 C+0 HETATM 195 C UNK 0 12.622 -9.212 0.000 0.00 0.00 C+0 HETATM 196 C UNK 0 43.804 -1.600 0.000 0.00 0.00 C+0 HETATM 197 C UNK 0 16.830 -6.902 0.000 0.00 0.00 C+0 HETATM 198 C UNK 0 32.412 -24.345 0.000 0.00 0.00 C+0 HETATM 199 C UNK 0 11.288 -9.982 0.000 0.00 0.00 C+0 HETATM 200 C UNK 0 41.723 0.559 0.000 0.00 0.00 C+0 HETATM 201 C UNK 0 40.168 2.726 0.000 0.00 0.00 C+0 HETATM 202 C UNK 0 45.268 -2.078 0.000 0.00 0.00 C+0 HETATM 203 C UNK 0 15.496 -7.672 0.000 0.00 0.00 C+0 HETATM 204 C UNK 0 16.830 -5.362 0.000 0.00 0.00 C+0 HETATM 205 C UNK 0 11.288 -6.902 0.000 0.00 0.00 C+0 HETATM 206 C UNK 0 27.912 -6.902 0.000 0.00 0.00 C+0 HETATM 207 C UNK 0 54.774 -1.115 0.000 0.00 0.00 C+0 HETATM 208 C UNK 0 25.245 -6.902 0.000 0.00 0.00 C+0 HETATM 209 C UNK 0 27.535 -15.069 0.000 0.00 0.00 C+0 HETATM 210 C UNK 0 25.802 -19.654 0.000 0.00 0.00 C+0 HETATM 211 C UNK 0 23.817 -18.043 0.000 0.00 0.00 C+0 HETATM 212 C UNK 0 11.288 -11.522 0.000 0.00 0.00 C+0 HETATM 213 C UNK 0 21.037 -7.672 0.000 0.00 0.00 C+0 HETATM 214 C UNK 0 36.532 -30.599 0.000 0.00 0.00 C+0 HETATM 215 C UNK 0 8.415 -6.902 0.000 0.00 0.00 C+0 HETATM 216 C UNK 0 31.454 -25.550 0.000 0.00 0.00 C+0 HETATM 217 C UNK 0 31.266 -23.317 0.000 0.00 0.00 C+0 HETATM 218 C UNK 0 42.974 1.457 0.000 0.00 0.00 C+0 HETATM 219 C UNK 0 41.419 3.624 0.000 0.00 0.00 C+0 HETATM 220 C UNK 0 19.703 -6.902 0.000 0.00 0.00 C+0 HETATM 221 C UNK 0 27.687 -11.999 0.000 0.00 0.00 C+0 HETATM 222 C UNK 0 28.034 -10.498 0.000 0.00 0.00 C+0 HETATM 223 C UNK 0 15.496 -4.592 0.000 0.00 0.00 C+0 HETATM 224 C UNK 0 28.660 -19.528 0.000 0.00 0.00 C+0 HETATM 225 C UNK 0 29.376 -20.891 0.000 0.00 0.00 C+0 HETATM 226 C UNK 0 23.911 -7.672 0.000 0.00 0.00 C+0 HETATM 227 C UNK 0 8.415 -5.362 0.000 0.00 0.00 C+0 HETATM 228 C UNK 0 25.245 -5.362 0.000 0.00 0.00 C+0 HETATM 229 C UNK 0 42.822 2.989 0.000 0.00 0.00 C+0 HETATM 230 C UNK 0 21.037 -9.212 0.000 0.00 0.00 C+0 HETATM 231 C UNK 0 7.081 -4.592 0.000 0.00 0.00 C+0 HETATM 232 C UNK 0 7.081 -7.672 0.000 0.00 0.00 C+0 HETATM 233 C UNK 0 14.162 -5.362 0.000 0.00 0.00 C+0 HETATM 234 C UNK 0 15.496 -3.052 0.000 0.00 0.00 C+0 HETATM 235 C UNK 0 23.911 -4.592 0.000 0.00 0.00 C+0 HETATM 236 C UNK 0 12.829 -4.592 0.000 0.00 0.00 C+0 HETATM 237 C UNK 0 14.162 -2.282 0.000 0.00 0.00 C+0 HETATM 238 C UNK 0 5.747 -5.362 0.000 0.00 0.00 C+0 HETATM 239 C UNK 0 7.081 -3.052 0.000 0.00 0.00 C+0 HETATM 240 C UNK 0 9.955 -13.832 0.000 0.00 0.00 C+0 HETATM 241 C UNK 0 12.829 -3.052 0.000 0.00 0.00 C+0 HETATM 242 C UNK 0 4.414 -4.592 0.000 0.00 0.00 C+0 HETATM 243 C UNK 0 5.747 -2.282 0.000 0.00 0.00 C+0 HETATM 244 C UNK 0 4.414 -3.052 0.000 0.00 0.00 C+0 CONECT 1 3 163 CONECT 2 171 191 CONECT 3 1 187 CONECT 4 104 CONECT 5 105 CONECT 6 110 CONECT 7 112 CONECT 8 116 CONECT 9 117 CONECT 10 118 CONECT 11 124 CONECT 12 129 CONECT 13 135 CONECT 14 139 CONECT 15 140 CONECT 16 151 CONECT 17 149 CONECT 18 150 CONECT 19 152 CONECT 20 157 CONECT 21 162 CONECT 22 165 CONECT 23 166 CONECT 24 168 CONECT 25 169 CONECT 26 168 CONECT 27 178 CONECT 28 181 CONECT 29 182 CONECT 30 186 CONECT 31 202 CONECT 32 203 CONECT 33 205 CONECT 34 206 CONECT 35 216 CONECT 36 209 CONECT 37 214 CONECT 38 217 CONECT 39 220 CONECT 40 222 CONECT 41 224 CONECT 42 226 CONECT 43 230 CONECT 44 232 CONECT 45 232 CONECT 46 235 CONECT 47 244 CONECT 48 100 103 105 CONECT 49 104 107 CONECT 50 106 112 CONECT 51 110 115 CONECT 52 113 122 CONECT 53 114 CONECT 54 118 120 CONECT 55 124 127 CONECT 56 122 CONECT 57 122 CONECT 58 129 131 CONECT 59 132 138 CONECT 60 135 137 CONECT 61 136 141 CONECT 62 138 CONECT 63 138 CONECT 64 140 144 CONECT 65 143 149 CONECT 66 141 CONECT 67 146 157 CONECT 68 141 CONECT 69 150 159 CONECT 70 152 158 CONECT 71 155 162 CONECT 72 156 173 CONECT 73 161 169 CONECT 74 166 172 CONECT 75 165 174 CONECT 76 167 182 CONECT 77 178 180 CONECT 78 173 CONECT 79 173 CONECT 80 177 207 CONECT 81 181 196 CONECT 82 186 198 CONECT 83 185 202 CONECT 84 190 203 CONECT 85 189 222 CONECT 86 193 224 CONECT 87 197 220 CONECT 88 206 208 CONECT 89 205 215 CONECT 90 209 221 CONECT 91 213 226 CONECT 92 217 225 CONECT 93 212 240 CONECT 94 207 CONECT 95 214 CONECT 96 207 CONECT 97 235 CONECT 98 240 CONECT 99 240 CONECT 100 48 101 104 CONECT 101 100 102 CONECT 102 101 103 CONECT 103 48 102 CONECT 104 4 49 100 CONECT 105 5 48 106 CONECT 106 50 105 109 CONECT 107 49 108 110 CONECT 108 107 111 CONECT 109 106 CONECT 110 6 51 107 CONECT 111 108 113 CONECT 112 7 50 114 CONECT 113 52 111 CONECT 114 53 112 116 CONECT 115 51 117 118 CONECT 116 8 114 119 CONECT 117 9 115 CONECT 118 10 54 115 CONECT 119 116 CONECT 120 54 121 124 CONECT 121 120 123 CONECT 122 52 56 57 CONECT 123 121 125 126 CONECT 124 11 55 120 CONECT 125 123 CONECT 126 123 CONECT 127 55 128 129 CONECT 128 127 130 CONECT 129 12 58 127 CONECT 130 128 132 CONECT 131 58 133 135 CONECT 132 59 130 CONECT 133 131 134 CONECT 134 133 136 CONECT 135 13 60 131 CONECT 136 61 134 CONECT 137 60 139 140 CONECT 138 59 62 63 CONECT 139 14 137 CONECT 140 15 64 137 CONECT 141 61 66 68 CONECT 142 143 145 147 CONECT 143 65 142 150 CONECT 144 64 151 152 CONECT 145 142 154 CONECT 146 67 148 149 CONECT 147 142 CONECT 148 146 153 CONECT 149 17 65 146 CONECT 150 18 69 143 CONECT 151 16 144 CONECT 152 19 70 144 CONECT 153 148 156 CONECT 154 145 CONECT 155 71 157 160 CONECT 156 72 153 CONECT 157 20 67 155 CONECT 158 70 163 165 CONECT 159 69 166 CONECT 160 155 168 CONECT 161 73 162 164 CONECT 162 21 71 161 CONECT 163 1 158 CONECT 164 161 171 CONECT 165 22 75 158 CONECT 166 23 74 159 CONECT 167 76 169 170 CONECT 168 24 26 160 CONECT 169 25 73 167 CONECT 170 167 175 CONECT 171 2 164 CONECT 172 74 178 179 CONECT 173 72 78 79 CONECT 174 75 176 181 CONECT 175 170 177 CONECT 176 174 184 CONECT 177 80 175 CONECT 178 27 77 172 CONECT 179 172 CONECT 180 77 183 186 CONECT 181 28 81 174 CONECT 182 29 76 185 CONECT 183 180 188 CONECT 184 176 200 201 CONECT 185 83 182 CONECT 186 30 82 180 CONECT 187 3 189 CONECT 188 183 214 CONECT 189 85 187 206 CONECT 190 84 195 205 CONECT 191 2 CONECT 192 193 194 CONECT 193 86 192 209 CONECT 194 192 210 211 CONECT 195 190 199 CONECT 196 81 202 CONECT 197 87 203 204 CONECT 198 82 216 217 CONECT 199 195 212 CONECT 200 184 218 CONECT 201 184 219 CONECT 202 31 83 196 CONECT 203 32 84 197 CONECT 204 197 223 CONECT 205 33 89 190 CONECT 206 34 88 189 CONECT 207 80 94 96 CONECT 208 88 226 228 CONECT 209 36 90 193 CONECT 210 194 CONECT 211 194 CONECT 212 93 199 CONECT 213 91 220 230 CONECT 214 37 95 188 CONECT 215 89 227 232 CONECT 216 35 198 CONECT 217 38 92 198 CONECT 218 200 229 CONECT 219 201 229 CONECT 220 39 87 213 CONECT 221 90 222 CONECT 222 40 85 221 CONECT 223 204 233 234 CONECT 224 41 86 225 CONECT 225 92 224 CONECT 226 42 91 208 CONECT 227 215 231 CONECT 228 208 235 CONECT 229 218 219 CONECT 230 43 213 CONECT 231 227 238 239 CONECT 232 44 45 215 CONECT 233 223 236 CONECT 234 223 237 CONECT 235 46 97 228 CONECT 236 233 241 CONECT 237 234 241 CONECT 238 231 242 CONECT 239 231 243 CONECT 240 93 98 99 CONECT 241 236 237 CONECT 242 238 244 CONECT 243 239 244 CONECT 244 47 242 243 MASTER 0 0 0 0 0 0 0 0 244 0 496 0 END SMILES for NP0136278 (Urodilatin)CCC(C)C1NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(O)=O)NC(=O)C(CCSC)NC(=O)C(CCCNC(N)=N)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CSSCC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)CNC1=O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(C)C)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(N)C(C)O INCHI for NP0136278 (Urodilatin)InChI=1S/C145H234N52O44S3/c1-11-72(6)112-137(238)171-60-106(208)172-73(7)113(214)177-86(40-41-103(146)205)122(223)190-95(63-198)116(217)170-61-108(210)175-88(51-70(2)3)114(215)169-62-109(211)176-100(133(234)187-92(56-104(147)206)127(228)193-97(65-200)130(231)186-91(54-77-27-16-13-17-28-77)126(227)180-82(31-20-45-163-142(153)154)119(220)189-94(139(240)241)55-78-36-38-79(204)39-37-78)68-243-244-69-101(134(235)185-90(53-76-25-14-12-15-26-76)115(216)168-58-105(207)167-59-107(209)174-80(29-18-43-161-140(149)150)117(218)182-87(42-50-242-10)123(224)188-93(57-110(212)213)128(229)181-85(124(225)196-112)34-23-48-166-145(159)160)195-132(233)99(67-202)194-131(232)98(66-201)192-120(221)83(32-21-46-164-143(155)156)178-118(219)81(30-19-44-162-141(151)152)179-125(226)89(52-71(4)5)184-129(230)96(64-199)191-121(222)84(33-22-47-165-144(157)158)183-135(236)102-35-24-49-197(102)138(239)74(8)173-136(237)111(148)75(9)203/h12-17,25-28,36-39,70-75,80-102,111-112,198-204H,11,18-24,29-35,40-69,148H2,1-10H3,(H2,146,205)(H2,147,206)(H,167,207)(H,168,216)(H,169,215)(H,170,217)(H,171,238)(H,172,208)(H,173,237)(H,174,209)(H,175,210)(H,176,211)(H,177,214)(H,178,219)(H,179,226)(H,180,227)(H,181,229)(H,182,218)(H,183,236)(H,184,230)(H,185,235)(H,186,231)(H,187,234)(H,188,224)(H,189,220)(H,190,223)(H,191,222)(H,192,221)(H,193,228)(H,194,232)(H,195,233)(H,196,225)(H,212,213)(H,240,241)(H4,149,150,161)(H4,151,152,162)(H4,153,154,163)(H4,155,156,164)(H4,157,158,165)(H4,159,160,166) 3D Structure for NP0136278 (Urodilatin) | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Synonyms |
| |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Chemical Formula | C145H234N52O44S3 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Average Mass | 3505.9260 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Monoisotopic Mass | 3503.68336 Da | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| IUPAC Name | 2-[2-(2-{2-[2-({52-[2-(2-{2-[2-(2-{2-[2-({1-[2-(2-amino-3-hydroxybutanamido)propanoyl]pyrrolidin-2-yl}formamido)-5-carbamimidamidopentanamido]-3-hydroxypropanamido}-4-methylpentanamido)-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido}-3-hydroxypropanamido)-3-hydroxypropanamido]-49-benzyl-28-(butan-2-yl)-31,40-bis(3-carbamimidamidopropyl)-19-(2-carbamoylethyl)-34-(carboxymethyl)-16-(hydroxymethyl)-22-methyl-10-(2-methylpropyl)-37-[2-(methylsulfanyl)ethyl]-6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51-hexadecaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazacyclotripentacontan-4-yl}formamido)-3-carbamoylpropanamido]-3-hydroxypropanamido}-3-phenylpropanamido)-5-carbamimidamidopentanamido]-3-(4-hydroxyphenyl)propanoic acid | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Traditional Name | urodilatin | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| CAS Registry Number | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| SMILES | CCC(C)C1NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(O)=O)NC(=O)C(CCSC)NC(=O)C(CCCNC(N)=N)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CSSCC(NC(=O)CNC(=O)C(CC(C)C)NC(=O)CNC(=O)C(CO)NC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)CNC1=O)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O)NC(=O)C(CO)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C(CCCNC(N)=N)NC(=O)C(CC(C)C)NC(=O)C(CO)NC(=O)C(CCCNC(N)=N)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(N)C(C)O | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| InChI Identifier | InChI=1S/C145H234N52O44S3/c1-11-72(6)112-137(238)171-60-106(208)172-73(7)113(214)177-86(40-41-103(146)205)122(223)190-95(63-198)116(217)170-61-108(210)175-88(51-70(2)3)114(215)169-62-109(211)176-100(133(234)187-92(56-104(147)206)127(228)193-97(65-200)130(231)186-91(54-77-27-16-13-17-28-77)126(227)180-82(31-20-45-163-142(153)154)119(220)189-94(139(240)241)55-78-36-38-79(204)39-37-78)68-243-244-69-101(134(235)185-90(53-76-25-14-12-15-26-76)115(216)168-58-105(207)167-59-107(209)174-80(29-18-43-161-140(149)150)117(218)182-87(42-50-242-10)123(224)188-93(57-110(212)213)128(229)181-85(124(225)196-112)34-23-48-166-145(159)160)195-132(233)99(67-202)194-131(232)98(66-201)192-120(221)83(32-21-46-164-143(155)156)178-118(219)81(30-19-44-162-141(151)152)179-125(226)89(52-71(4)5)184-129(230)96(64-199)191-121(222)84(33-22-47-165-144(157)158)183-135(236)102-35-24-49-197(102)138(239)74(8)173-136(237)111(148)75(9)203/h12-17,25-28,36-39,70-75,80-102,111-112,198-204H,11,18-24,29-35,40-69,148H2,1-10H3,(H2,146,205)(H2,147,206)(H,167,207)(H,168,216)(H,169,215)(H,170,217)(H,171,238)(H,172,208)(H,173,237)(H,174,209)(H,175,210)(H,176,211)(H,177,214)(H,178,219)(H,179,226)(H,180,227)(H,181,229)(H,182,218)(H,183,236)(H,184,230)(H,185,235)(H,186,231)(H,187,234)(H,188,224)(H,189,220)(H,190,223)(H,191,222)(H,192,221)(H,193,228)(H,194,232)(H,195,233)(H,196,225)(H,212,213)(H,240,241)(H4,149,150,161)(H4,151,152,162)(H4,153,154,163)(H4,155,156,164)(H4,157,158,165)(H4,159,160,166) | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| InChI Key | IUCCYQIEZNQWRS-UHFFFAOYSA-N | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Experimental Spectra | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Not Available | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Predicted Spectra | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
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| Chemical Shift Submissions | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Not Available | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Species | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Species of Origin | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Chemical Taxonomy | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Description | Belongs to the class of organic compounds known as polypeptides. These are peptides containing ten or more amino acid residues. | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Kingdom | Organic compounds | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Super Class | Organic Polymers | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Class | Polypeptides | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Sub Class | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Direct Parent | Polypeptides | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Alternative Parents |
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| Substituents |
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| Molecular Framework | Aromatic heteromonocyclic compounds | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| External Descriptors | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Physical Properties | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| State | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Experimental Properties |
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| Predicted Properties |
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| External Links | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| HMDB ID | HMDB0042057 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| DrugBank ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Phenol Explorer Compound ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| FoodDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| KNApSAcK ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Chemspider ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| KEGG Compound ID | C16000 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| BioCyc ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| BiGG ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Wikipedia Link | Urodilatin | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| METLIN ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| PubChem Compound | 57320831 | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| PDB ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| ChEBI ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| Good Scents ID | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| References | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
| General References | Not Available | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||
