CFam Chemical Families Database
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You are searching for "CFAMM00257699" in compound.

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CFAM Mol ID CFAMM00257699
Family CFFID2034 Proto-oncogene tyrosine-protein kinase Src Inhibitor Ac-cys-ile-tyr-lys-phe(4-i)-tyr Family
Superfamily CFSID1525 Proto-oncogene tyrosine-protein kinase Src Inhibitor Ac-cys-ile-tyr-lys-phe(4-i)-tyr Superfamily
Class CFCID978 Class 2328
External ID CHEMBL542189 External Source CHEMBL
PubChem CID 45261297 Functional Category Bioactive
Molecule Name (2S)-2-[[(2S)-2-[[(2S)-2-[(5-bromo-2-hydroxyphenyl)methylamino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoic acid;hydrochloride
IUPAC Name (2S)-2-[[(2S)-2-[[(2S)-2-[(5-bromo-2-hydroxyphenyl)methylamino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoic acid;hydrochloride
Synonyms CHEBI:646380
InChi InChI=1S/C26H34BrN3O5S.ClH/c1-16(2)23(28-15-18-14-19(27)9-10-22(18)31)25(33)30-21(13-17-7-5-4-6-8-17)24(32)29-20(26(34)35)11-12-36-3;/h4-10,14,16,20-21,23,28,31H,11-13,15H2,1-3H3,(H,29,32)(H,30,33)(H,34,35);1H/t20-,21-,23-;/m0./s1
InChiKey UDHFXNFSGPAEMT-XCZLHMEYSA-N
Formula C26H35BrClN3O5S Molecular Weight 617.00
Cross Link CHEMBL542189
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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