CFam Chemical Families Database
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You are searching for "CFAMM00428229" in compound.

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CFAM Mol ID CFAMM00428229
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 ZINC02131270 External Source ZINC
PubChem CID 1786773 Functional Category Natural Product
Molecule Name AC1LWVZN
IUPAC Name (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoate
Synonyms ZINC02131270;(2S)-3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoate
InChi InChI=1S/C24H22N2O7/c1-12-16-5-4-15(32-2)9-21(16)33-24(31)17(12)10-22(28)26-20(23(29)30)7-13-11-25-19-6-3-14(27)8-18(13)19/h3-6,8-9,11,20,25,27H,7,10H2,1-2H3,(H,26,28)(H,29,30)/p-1/t20-/m0/s1
InChiKey LVBWHHDMQBJNOD-FQEVSTJZSA-M
Formula C24H21N2O7- Molecular Weight 449.43
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
 

 

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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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