CFam Chemical Families Database
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You are searching for "CFAMM00432258" in compound.

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CFAM Mol ID CFAMM00432258
Family CFFBM15087 Follicle-stimulating hormone receptor ligand N-[[3-[4-[[(2S,5S)-1,5-dimethyl-4-octyl-3,6-dioxopiperazin-2-yl]methyl]phenyl]phenyl]methyl]-N-(methoxymethyl)acetamide family
Superfamily CFSCD340 Kappa-type opioid receptor Ligand Asimadoline Superfamily
Class CFCCD249 Class 1062
External ID CHEMBL49608 External Source CHEMBL
PubChem CID 44293189 Functional Category Bioactive
Molecule Name 1-butyl-1-[[3-[4-[[(2S,5S)-4-hexyl-1,5-dimethyl-3,6-dioxopiperazin-2-yl]methyl]phenyl]phenyl]methyl]-3-methylurea
IUPAC Name 1-butyl-1-[[3-[4-[[(2S,5S)-4-hexyl-1,5-dimethyl-3,6-dioxopiperazin-2-yl]methyl]phenyl]phenyl]methyl]-3-methylurea
Synonyms CHEBI:172491
InChi InChI=1S/C32H46N4O3/c1-6-8-10-11-20-36-24(3)30(37)34(5)29(31(36)38)22-25-15-17-27(18-16-25)28-14-12-13-26(21-28)23-35(19-9-7-2)32(39)33-4/h12-18,21,24,29H,6-11,19-20,22-23H2,1-5H3,(H,33,39)/t24-,29-/m0/s1
InChiKey LTPNZUAMKQUIHB-OUTSHDOLSA-N
Formula C32H46N4O3 Molecular Weight 534.73
Cross Link CHEMBL49608
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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National University of Singapore, Singapore


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