CFAM Mol ID	CFAMM00428238
Family	CFFBM14395 Vasopressin V2 receptor and Vasopressin V1a receptor ligand 2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S,3S)-2-[[(2R)-3-(1H-indol-3-yl)-2-[(7-methoxy-2-oxochromene-4-carbonyl)amino]propanoyl]amino]-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoyl]amino]-3-sulfanylpropanoyl]-methylamino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetic acid family
Superfamily	CFSAD806 ostatin receptor 5 Ligand Pasireotide Diaspartate Superfamily
Class	CFCAD546 Class 546
External ID	ZINC02102352	External Source	ZINC
PubChem CID	5573137	Functional Category	Natural Product
Molecule Name	AC1NVOSO
IUPAC Name	(2S)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate
Synonyms	ZINC02102352;(2S)-2-[3-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate
InChi	InChI=1S/C25H24N2O6/c1-13-16-7-9-21(28)14(2)23(16)33-25(32)17(13)8-10-22(29)27-20(24(30)31)11-15-12-26-19-6-4-3-5-18(15)19/h3-7,9,12,20,26,28H,8,10-11H2,1-2H3,(H,27,29)(H,30,31)/p-1/t20-/m0/s1
InChiKey	WOWPBVQNTGJSIH-FQEVSTJZSA-M
Formula	C25H23N2O6-	Molecular Weight	447.46
Cross Link
Structure

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

Last update by

2014.08.29

48680 visits since 2014 .........

Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

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