CFam Chemical Families Database
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You are searching for "CFAMM00534129" in compound.

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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 CFAMM00534129
Family CFFHM351 Steroids and Steroid Derivatives Metabolite 5b-Pregnanediol Family
Superfamily CFSHM225 Steroids and Steroid Derivatives Metabolite 5b-Pregnanediol Superfamily
Class CFCHM149 Class 7234
External ID HMDB41632 External Source HMDB
PubChem CID 2723895 Functional Category Human Metabolite
Molecule Name 5alpha-Cholestane
IUPAC Name (1S,2S,7R,10R,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane
Synonyms (5alpha)-Cholestane;28,29,30-Trinorlanostane;5alpha-Cholestane;5alpha-Cholestane (8CI);alpha-Cholestane;Cholestane
InChi InChI=1/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/s2
InChiKey XIIAYQZJNBULGD-JFKFUREVNA-N
Formula C27H48 Molecular Weight 372.67
Cross Link CHEMBL3138638
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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