CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00574679" in compound.

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CFAM Mol ID CFAMM00574679
Family CFFNP4718 benzenesulfonate NP ZINC09051160 Family
Superfamily CFSNP456 benzenesulfonate NP (z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl Benzenesulfonate Superfamily
Class CFCBM1919 Class 4969
External ID ZINC09419470 External Source ZINC
PubChem CID 16419192 Functional Category Natural Product
Molecule Name STOCK6S-30430
IUPAC Name [(2Z)-3-oxo-2-[(4-propan-2-ylphenyl)methylidene]-1-benzofuran-6-yl] 4-methylbenzenesulfonate
Synonyms MolPort-000-849-196;STK619142;ZINC09419470;AKOS002292720;ST50795710;2-{[4-(methylethyl)phenyl]methylene}-3-oxobenzo[3,4-b]furan-6-yl 4-methylbenze nesulfonate;(2Z)-3-oxo-2-[4-(propan-2-yl)benzylidene]-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate
InChi InChI=1S/C25H22O5S/c1-16(2)19-8-6-18(7-9-19)14-24-25(26)22-13-10-20(15-23(22)29-24)30-31(27,28)21-11-4-17(3)5-12-21/h4-16H,1-3H3/b24-14-
Formula C25H22O5S Molecular Weight 434.50
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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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National University of Singapore, Singapore

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