CFam Chemical Families Database
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You are searching for "CFAMM00124737" in compound.

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CFAM Mol ID CFAMM00124737
Family CFFAD1070 Salicin family
Superfamily CFSAD899 Salicin Superfamily
Class CFCAD785 Class 785
External ID DNAP001622 External Source TTD
PubChem CID 439503 Functional Category Approved Drug
Molecule Name Salicin
IUPAC Name (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
Synonyms Salicoside;Salicine;138-52-3;Salicyl alcohol glucoside;Saligenin beta-D-glucopyranoside;D-(-)-Salicin;2-(Hydroxymethyl)phenyl beta-D-glucopyranoside;Saligenin-beta-D-glucopyranoside;Salicin (6CI,8CI);o-(Hydroxymethyl)phenyl beta-D-glucopyranoside
InChi InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
InChiKey NGFMICBWJRZIBI-UJPOAAIJSA-N
Formula C13H18O7 Molecular Weight 286.28
Cross Link CHEMBL462997
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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