CFam Chemical Families Database
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You are searching for "CFAMM00124456" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00124456
Family CFFAD1070 Salicin family
Superfamily CFSAD899 Salicin Superfamily
Class CFCAD785 Class 785
External ID ZINC03809580 External Source ZINC
PubChem CID 72414 Functional Category Natural Product
Molecule Name suksdorfin
IUPAC Name [(9R,10R)-9-acetyloxy-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 3-methylbutanoate
Synonyms NSC666862;(9r,10r)-9-(acetyloxy)-8,8-dimethyl-2-oxo-9,10-dihydro-2h,8h-pyrano[2,3-f]chromen-10-yl 3-methylbutanoate;53023-17-9;Saxdorphin;AC1Q6BHR;Pyranocoumarin iBuCOO deriv.;MLS000574879;CHEMBL68956;AC1L2I14;STOCK1N-52768
InChi InChI=1S/C21H24O7/c1-11(2)10-16(24)27-19-17-14(28-21(4,5)20(19)25-12(3)22)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3/t19-,20-/m1/s1
InChiKey KLUTZDJBVDPOFE-WOJBJXKFSA-N
Formula C21H24O7 Molecular Weight 388.41
Cross Link CHEMBL68956
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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