CFam Chemical Families Database
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You are searching for "CFAMM00320647" in compound.

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CFAM Mol ID CFAMM00320647
Family CFFBM1210 Cholecystokinin receptor type A and Gastrin/cholecystokinin type B receptor ligand IQM95333 family
Superfamily CFSBM690 Renin and Prothrombin Binder Superfamily
Class CFCAD639 Class 639
External ID CHEMBL189634 External Source CHEMBL
PubChem CID 11027990 Functional Category Bioactive
Molecule Name tert-butyl N-[(2S)-1-[[(4aS,5R)-1,3-dioxo-2-phenyl-4,4a,5,6,7,8-hexahydropyrido[1,2-c]pyrimidin-5-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
IUPAC Name tert-butyl N-[(2S)-1-[[(4aS,5R)-1,3-dioxo-2-phenyl-4,4a,5,6,7,8-hexahydropyrido[1,2-c]pyrimidin-5-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate
Synonyms CHEBI:417106
InChi InChI=1S/C30H35N5O5/c1-30(2,3)40-28(38)33-24(16-19-18-31-22-13-8-7-12-21(19)22)27(37)32-23-14-9-15-34-25(23)17-26(36)35(29(34)39)20-10-5-4-6-11-20/h4-8,10-13,18,23-25,31H,9,14-17H2,1-3H3,(H,32,37)(H,33,38)/t23-,24+,25+/m1/s1
InChiKey GJIMVDRKIKKNJY-DSITVLBTSA-N
Formula C30H35N5O5 Molecular Weight 545.63
Cross Link CHEMBL189634
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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