CFam Chemical Families Database
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You are searching for "CFAMM00379258" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00379258
Family CFFBM7346 Growth factor receptor-bound protein 2 ligand 2-[(9S,10S,11E,14S,18S)-18-(2-amino-2-oxoethyl)-14-(naphthalen-1-ylmethyl)-8,17,20-trioxo-10-[4-(phosphonomethyl)phenyl]-7,16,19-triazaspiro[5.14]icos-11-en-9-yl]acetic acid family
Superfamily CFSBM4127 Growth factor receptor-bound protein 2 Binder Superfamily
Class CFCBM1496 Class 4546
External ID CHEMBL1672710 External Source CHEMBL
PubChem CID 53321378 Functional Category Bioactive
Molecule Name (3R)-4-[[1-[[(2S)-3-carboxy-1-(3-naphthalen-1-ylpropylamino)-1-oxopropan-2-yl]carbamoyl]cyclohexyl]amino]-4-oxo-3-[[4-(phosphonomethyl)phenyl]methyl]butanoic acid
IUPAC Name (3R)-4-[[1-[[(2S)-3-carboxy-1-(3-naphthalen-1-ylpropylamino)-1-oxopropan-2-yl]carbamoyl]cyclohexyl]amino]-4-oxo-3-[[4-(phosphonomethyl)phenyl]methyl]butanoic acid
Synonyms CHEBI:1170134
InChi InChI=1S/C36H44N3O10P/c40-31(41)21-28(20-24-13-15-25(16-14-24)23-50(47,48)49)33(44)39-36(17-4-1-5-18-36)35(46)38-30(22-32(42)43)34(45)37-19-7-11-27-10-6-9-26-8-2-3-12-29(26)27/h2-3,6,8-10,12-16,28,30H,1,4-5,7,11,17-23H2,(H,37,45)(H,38,46)(H,39,44)(H,40,41)(H,42,43)(H2,47,48,49)/t28-,30+/m1/s1
InChiKey QBSUVBVVFJXUOM-DGPALRBDSA-N
Formula C36H44N3O10P Molecular Weight 709.72
Cross Link CHEMBL1672710
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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