CFam Chemical Families Database
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You are searching for "CFAMM00281563" in compound.

Total 1 results found.

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 CFAMM00281563
Family CFFID2996 Angiotensin-converting enzyme and Endothelin-converting enzyme 1 Inhibitor SCH-54470 Family
Superfamily CFSAD718 Bacterial outer membrane Inhibitor Daptomycin Superfamily
Class CFCAD647 Class 647
External ID CHEMBL43114 External Source CHEMBL
PubChem CID 22857948 Functional Category Bioactive
Molecule Name SureCN8024454
IUPAC Name (2S)-2-[[1-[[hydroxy-[(1R)-1-[(4-nitrobenzoyl)amino]-2-phenylethyl]phosphoryl]methyl]cyclopentanecarbonyl]amino]-3-(1H-indol-3-yl)propanoic acid
Synonyms CHEBI:164610
InChi InChI=1S/C33H35N4O8P/c38-30(23-12-14-25(15-13-23)37(42)43)36-29(18-22-8-2-1-3-9-22)46(44,45)21-33(16-6-7-17-33)32(41)35-28(31(39)40)19-24-20-34-27-11-5-4-10-26(24)27/h1-5,8-15,20,28-29,34H,6-7,16-19,21H2,(H,35,41)(H,36,38)(H,39,40)(H,44,45)/t28-,29+/m0/s1
InChiKey JEFBYIWPDIJORK-URLMMPGGSA-N
Formula C33H35N4O8P Molecular Weight 646.63
Cross Link CHEMBL43114
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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