CFam Chemical Families Database
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You are searching for "CFAMM00400175" in compound.

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CFAM Mol ID CFAMM00400175
Family CFFBM10184 Vascular endothelial growth factor receptor 2 and Vascular endothelial growth factor receptor 3 ligand 1H-Pyrrole-2,5-dione, 3-(1H-indol-3-yl)-4-(3,4,5-trimethoxyphenyl)- family
Superfamily CFSBM288 Vascular endothelial growth factor receptor 2 and Glycogen synthase kinase-3 beta Binder Superfamily
Class CFCID1148 Class 2498
External ID ZINC20113904 External Source ZINC
PubChem CID 1792827 Functional Category Natural Product
Molecule Name (E)-4-(1H-indol-3-yl)-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)but-3-en-2-one
IUPAC Name (E)-4-(1H-indol-3-yl)-1-[(5R)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]but-3-en-2-one
Synonyms ZINC20113904;(E)-4-(1H-indol-3-yl)-1-[(5R)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]but-3-en-2-one
InChi InChI=1S/C24H24N2O4/c1-26-10-9-15-11-21-23(30-14-29-21)24(28-2)22(15)20(26)12-17(27)8-7-16-13-25-19-6-4-3-5-18(16)19/h3-8,11,13,20,25H,9-10,12,14H2,1-2H3/b8-7+/t20-/m1/s1
InChiKey SFCDKHFGEPUQLE-AQKVLALTSA-N
Formula C24H24N2O4 Molecular Weight 404.46
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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