CFam Chemical Families Database
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You are searching for "CFAMM00233240" in compound.

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CFAM Mol ID CFAMM00233240
Family CFFID1249 Somatostatin receptor type 1 Ligand Des-aa1,2,5-[(nalphame)lys4,d-nal8,iamp9]srif Family
Superfamily CFSID946 Genome polyprotein and Delta-type opioid receptor Binder Superfamily
Class CFCID656 Class 2006
External ID CHEMBL274644 External Source CHEMBL
PubChem CID 44265630 Functional Category Bioactive
Molecule Name (3R,4R)-3-hydroxy-6-methyl-N-[(2S)-2-methylbutyl]-4-[[2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]-2-phenylsulfanylacetyl]amino]heptanamide
IUPAC Name (3R,4R)-3-hydroxy-6-methyl-N-[(2S)-2-methylbutyl]-4-[[2-[[3-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoyl]amino]-2-phenylsulfanylacetyl]amino]heptanamide
Synonyms CHEBI:104668
InChi InChI=1S/C45H53N3O4S/c1-5-31(4)29-46-42(50)28-41(49)40(25-30(2)3)47-44(52)45(53-37-21-7-6-8-22-37)48-43(51)36(26-34-19-13-17-32-15-9-11-23-38(32)34)27-35-20-14-18-33-16-10-12-24-39(33)35/h6-24,30-31,36,40-41,45,49H,5,25-29H2,1-4H3,(H,46,50)(H,47,52)(H,48,51)/t31-,40+,41+,45?/m0/s1
InChiKey ZWZVFPIJENJSRP-QYYLXOGGSA-N
Formula C45H53N3O4S Molecular Weight 731.99
Cross Link CHEMBL274644
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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