CFam Chemical Families Database
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You are searching for "CFAMM00419283" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

Search Results

CFAM Mol ID CFAMM00419283
Family CFFBM12953 Peroxisome proliferator-activated receptor delta and Peroxisome proliferator-activated receptor gamma ligand AGN-PC-076BJY family
Superfamily CFSBM5899 Beta-2 adrenergic receptor and Peroxisome proliferator-activated receptor gamma Binder Superfamily
Class CFCBM122 Class 3172
External ID ZINC02100833 External Source ZINC
PubChem CID 1756644 Functional Category Natural Product
Molecule Name AC1LWQWH
IUPAC Name methyl 5-bromo-3-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]amino]-1H-indole-2-carboxylate
Synonyms ZINC02100833;methyl 5-bromo-3-[[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]amino]-1H-indole-2-carboxylate
InChi InChI=1S/C23H24BrN3O5/c1-30-18-8-13-6-7-27(11-14(13)9-19(18)31-2)12-20(28)26-21-16-10-15(24)4-5-17(16)25-22(21)23(29)32-3/h4-5,8-10,25H,6-7,11-12H2,1-3H3,(H,26,28)/p+1
InChiKey SCYJULKYDWYJQC-UHFFFAOYSA-O
Formula C23H25BrN3O5+ Molecular Weight 503.37
Cross Link
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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