CFam Chemical Families Database
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You are searching for "CFAMM00570865" in compound.

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CFAM Mol ID CFAMM00570865
Family CFFNP3536 benzenesulfonate NP (z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl Benzenesulfonate 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 ZINC09347763 External Source ZINC
PubChem CID 1855906 Functional Category Natural Product
Molecule Name AC1LXQLP
IUPAC Name [(2Z)-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] 4-methoxybenzenesulfonate
Synonyms STOCK5S-39776;MolPort-002-640-821;MolPort-019-877-579;STK848624;ZINC09347763;AKOS002218172;ST50475032;AB01315554-02;AO-022/43453340;F3385-2477
InChi InChI=1S/C25H22O9S/c1-29-16-6-9-18(10-7-16)35(27,28)34-17-8-11-19-21(14-17)33-22(23(19)26)13-15-5-12-20(30-2)25(32-4)24(15)31-3/h5-14H,1-4H3/b22-13-
InChiKey CGVNFPIHFGOANH-XKZIYDEJSA-N
Formula C25H22O9S Molecular Weight 498.50
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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