CFam Chemical Families Database
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You are searching for "CFAMM00101761" in compound.

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CFAM Mol ID CFAMM00101761
Family CFFAD765 Mu-type opioid receptor Ligand Alvimopan Family
Superfamily CFSAD641 Mu-type opioid receptor Ligand Alvimopan Superfamily
Class CFCAD323 Class 323
External ID CHEMBL297301 External Source CHEMBL
PubChem CID 44290617 Functional Category Bioactive
Molecule Name tert-butyl N-[(2R)-1-[[(2R)-1-[4-(4-hydroxyphenyl)butylamino]-2-methyl-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
IUPAC Name tert-butyl N-[(2R)-1-[[(2R)-1-[4-(4-hydroxyphenyl)butylamino]-2-methyl-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate
Synonyms CHEBI:167211
InChi InChI=1S/C34H43N3O5/c1-33(2,3)42-32(41)36-29(23-26-14-7-5-8-15-26)30(39)37-34(4,24-27-16-9-6-10-17-27)31(40)35-22-12-11-13-25-18-20-28(38)21-19-25/h5-10,14-21,29,38H,11-13,22-24H2,1-4H3,(H,35,40)(H,36,41)(H,37,39)/t29-,34-/m1/s1
InChiKey NEAXLFOXMIBFAY-ANHUGMMASA-N
Formula C34H43N3O5 Molecular Weight 573.72
Cross Link CHEMBL297301
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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