CFam Chemical Families Database
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You are searching for "CFAMM00533696" in compound.

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CFAM Mol ID CFAMM00533696
Family CFFHM335 Steroids and Steroid Derivatives Metabolite 2-Methoxyestrone 3-glucuronide Family
Superfamily CFSAD414 DNA topoisomerase 2-beta Inhibitor Etoposide Superfamily
Class CFCAD384 Class 384
External ID 193609 External Source PubChem
PubChem CID 193609 Functional Category Patent Compound
Molecule Name Estrone glucoside
IUPAC Name (8R,9S,13S,14S)-13-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Synonyms AC1L4WNE;Estrone-3-beta-D-glucopyranoside;25591-03-1;AR-1I7219;estra-1,3,5(10)-trien-17-one, 3-(|A-d-glucopyranosyloxy)-;Estra-1,3,5(10)-trien-17-one, 3-(beta-D-glucopyranosyloxy)-;(8R,9S,13S,14S)-13-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
InChi InChI=1S/C24H32O7/c1-24-9-8-15-14-5-3-13(30-23-22(29)21(28)20(27)18(11-25)31-23)10-12(14)2-4-16(15)17(24)6-7-19(24)26/h3,5,10,15-18,20-23,25,27-29H,2,4,6-9,11H2,1H3/t15-,16-,17+,18-,20-,21+,22-,23-,24+/m1/s1
Formula C24H32O7 Molecular Weight 432.51
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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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