CFam Chemical Families Database
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You are searching for "CFAMM00257687" in compound.

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CFAM Mol ID CFAMM00257687
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 CHEMBL277238 External Source CHEMBL
PubChem CID 5289470 Functional Category Bioactive
Molecule Name TI2
IUPAC Name (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-sulfanylpropanoyl]amino]propanoyl]amino]propanoic acid
Synonyms (2-SULFANYL-3-PHENYLPROPANOYL)-PHE-TYR;AC1NRDCM;1qf0;CHEBI:123652;(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-3-phenyl-2-[[(2S)-3-phenyl-2-sulfanylpropanoyl]amino]propanoyl]amino]propanoic acid
InChi InChI=1S/C27H28N2O5S/c30-21-13-11-20(12-14-21)16-23(27(33)34)29-25(31)22(15-18-7-3-1-4-8-18)28-26(32)24(35)17-19-9-5-2-6-10-19/h1-14,22-24,30,35H,15-17H2,(H,28,32)(H,29,31)(H,33,34)/t22-,23-,24-/m0/s1
InChiKey GIVBBFGMRNXKPE-HJOGWXRNSA-N
Formula C27H28N2O5S Molecular Weight 492.59
Cross Link CHEMBL277238
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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