CFam Chemical Families Database
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You are searching for "CFAMM00295007" in compound.

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CFAM Mol ID CFAMM00295007
Family CFFID3631 Genome polyprotein Inhibitor Acasp-glu-dif-glu-cha-cys Family
Superfamily CFSAD173 Vasopressin V1a receptor Ligand Felypressin Superfamily
Class CFCAD168 Class 168
External ID CHEMBL376815 External Source CHEMBL
PubChem CID 11693095 Functional Category Bioactive
Molecule Name tert-butyl (4S)-4-[(2,2-diphenylacetyl)amino]-5-[[(2S)-1-[[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate
IUPAC Name tert-butyl (4S)-4-[(2,2-diphenylacetyl)amino]-5-[[(2S)-1-[[(E,3S)-5-methyl-1-methylsulfonylhex-1-en-3-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate
Synonyms CHEBI:446716
InChi InChI=1S/C34H47N3O7S/c1-23(2)22-27(20-21-45(7,42)43)36-31(39)24(3)35-32(40)28(18-19-29(38)44-34(4,5)6)37-33(41)30(25-14-10-8-11-15-25)26-16-12-9-13-17-26/h8-17,20-21,23-24,27-28,30H,18-19,22H2,1-7H3,(H,35,40)(H,36,39)(H,37,41)/b21-20+/t24-,27+,28-/m0/s1
InChiKey ILPPYSQNXLYJCB-BHLSWWIFSA-N
Formula C34H47N3O7S Molecular Weight 641.82
Cross Link CHEMBL376815
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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