Details of the Drug

General Information of Drug (ID: DM57MIW)

Drug Name
13-HODE
Synonyms alpha-artemisolic acid; 13-hydroxylinoleic acid; coriolic acid
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL is unavailable 2D MOL
Chemical Identifiers
Formula
C18H32O3
Canonical SMILES
CCCCCC(C=CC=CCCCCCCCC(=O)O)O
InChI
1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+
InChIKey
HNICUWMFWZBIFP-BSZOFBHHSA-N
Cross-matching ID
PubChem CID
5282947
ChEBI ID
CHEBI:72639
CAS Number
18104-45-5
TTD ID
D02JWD

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5426).