CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00541579" 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 CFAMM00541579
Family CFFHM1451 Prenol Lipids Metabolite Vitamin A2 aldehyde Family
Superfamily CFSBM11140 Cellular tumor antigen p53 and Tyrosyl-DNA phosphodiesterase 1 inhibitor retinal Superfamily
Class CFCBM3130 Class 6180
External ID HMDB35695 External Source HMDB
PubChem CID 5280866 Functional Category Human Metabolite
Molecule Name Vitamin A2 aldehyde
IUPAC Name (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenal
Synonyms 3,4-Didehydroretinal;3-Dehydroretinal;3-Dehydroretinaldehyde;All-trans-3,4-Dehydroretinal;All-trans-3-Dehydroretinal;All-trans-dehydroretinal;alpha-Retinene;Dehydroretinal;Dehydroretinaldehyde;Didehydroretinal;Retinene2;trans-3-Dehydroretinal;Vitamin A2 aldehyde
InChi InChI=1S/C20H26O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6-13,15H,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+
InChiKey QHNVWXUULMZJKD-OVSJKPMPSA-N
Formula C20H26O Molecular Weight 282.42
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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