CFam Chemical Families Database
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You are searching for "CFAMM00436551" in compound.

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CFAM Mol ID CFAMM00436551
Family CFFBM15979 Gastrin/cholecystokinin type B receptor ligand CHEMBL338525 family
Superfamily CFSBM6737 T-cell surface glycoprotein CD4 and Gastrin/cholecystokinin type B receptor Binder Superfamily
Class CFCID1690 Class 3040
External ID CHEMBL283040 External Source CHEMBL
PubChem CID 44280162 Functional Category Bioactive
Molecule Name (2R,4S)-1-[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoyl]-4-(2,4-dichlorophenoxy)piperidine-2-carboxylic acid
IUPAC Name (2R,4S)-1-[(2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoyl]-4-(2,4-dichlorophenoxy)piperidine-2-carboxylic acid
Synonyms CHEBI:144260
InChi InChI=1S/C35H39Cl2N3O6/c1-35(17-23-18-38-28-5-3-2-4-26(23)28,39-34(44)46-31-21-11-19-10-20(13-21)14-22(31)12-19)33(43)40-9-8-25(16-29(40)32(41)42)45-30-7-6-24(36)15-27(30)37/h2-7,15,18-22,25,29,31,38H,8-14,16-17H2,1H3,(H,39,44)(H,41,42)/t19?,20?,21?,22?,25-,29+,31?,35+/m0/s1
InChiKey IDKSGHOHJZZRDZ-MYJMFBNBSA-N
Formula C35H39Cl2N3O6 Molecular Weight 668.61
Cross Link CHEMBL283040
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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