CFam Chemical Families Database
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You are searching for "CFAMM00306778" 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 CFAMM00306778
Family CFFBM77 Integrin beta-1 and Integrin alpha-4 inhibitor (3S)-3-(3,4-dimethoxyphenyl)-3-[[2-[3-methoxypropyl-[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]amino]acetyl]amino]propanoic acid family
Superfamily CFSID2854 Genome polyprotein Inhibitor Azapeptide Derivative Superfamily
Class CFCCD141 Class 954
External ID 54526217 External Source PubChem
PubChem CID 54526217 Functional Category Patent Compound
Molecule Name AGN-PC-0A7GQI
IUPAC Name 3-[2-[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]propanoylamino]ethylcarbamoyl-methylamino]-2-methylpropanoic acid
Synonyms SureCN7432109;3-[2-[3-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]propanoylamino]ethylcarbamoyl-methylamino]-2-methylpropanoic acid
InChi InChI=1S/C26H35N5O6/c1-17-7-5-6-8-20(17)29-25(35)30-21-11-9-19(15-22(21)37-4)10-12-23(32)27-13-14-28-26(36)31(3)16-18(2)24(33)34/h5-9,11,15,18H,10,12-14,16H2,1-4H3,(H,27,32)(H,28,36)(H,33,34)(H2,29,30,35)
InChiKey YTGSRJUCDSLEDR-UHFFFAOYSA-N
Formula C26H35N5O6 Molecular Weight 513.59
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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