CFam Chemical Families Database
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You are searching for "CFAMM00431093" 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 CFAMM00431093
Family CFFBM14920 C-C chemokine receptor type 3 ligand SureCN3935453 family
Superfamily CFSBM6462 Chymotrypsinogen A and Cruzipain Binder Superfamily
Class CFCID1622 Class 2972
External ID CHEMBL32692 External Source CHEMBL
PubChem CID 44281789 Functional Category Bioactive
Molecule Name SureCN3926453
IUPAC Name benzyl (2S)-2-(naphthalene-1-carbonylamino)-3-(4-nitrophenyl)propanoate
Synonyms CHEBI:147479
InChi InChI=1S/C27H22N2O5/c30-26(24-12-6-10-21-9-4-5-11-23(21)24)28-25(17-19-13-15-22(16-14-19)29(32)33)27(31)34-18-20-7-2-1-3-8-20/h1-16,25H,17-18H2,(H,28,30)/t25-/m0/s1
InChiKey RSPAJTRUGCCBJD-VWLOTQADSA-N
Formula C27H22N2O5 Molecular Weight 454.47
Cross Link CHEMBL32692
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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