CFam Chemical Families Database
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You are searching for "CFAMM00072094" in compound.

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CFAM Mol ID CFAMM00072094
Family CFFAD519 Multidrug resistance protein Inhibitor Benzquinamide Family
Superfamily CFSAD451 ABC transporter inhibitor Benzquinamide, amine transporter inhibitor Tetrabenazine Superfamily
Class CFCAD92 Class 92
External ID ZINC04060990 External Source ZINC
PubChem CID 16399216 Functional Category Natural Product
Molecule Name ((1R,4aS,8aS)-1-(benzo[d][1,3]dioxol-5-yl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)(phenyl)methanone
IUPAC Name [(1R,4aS,8aS)-1-(1,3-benzodioxol-5-yl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-phenylmethanone
Synonyms MolPort-002-519-743;ZINC04060990
InChi InChI=1S/C23H25NO4/c25-22(16-6-2-1-3-7-16)24-13-12-23(26)11-5-4-8-18(23)21(24)17-9-10-19-20(14-17)28-15-27-19/h1-3,6-7,9-10,14,18,21,26H,4-5,8,11-13,15H2/t18-,21-,23-/m0/s1
Formula C23H25NO4 Molecular Weight 379.45
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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).

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