Chemical Component Summary

Name(9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid
Identifiers(9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid
FormulaC18 H32 O3
Molecular Weight296.445
TypeNON-POLYMER
Isomeric SMILESCCCCC\C=C/C=C/[C@H](CCCCCCCC(=O)O)O
InChIInChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+/t17-/m1/s1
InChIKeyNPDSHTNEKLQQIJ-UINYOVNOSA-N

Chemical Details

Formal Charge0
Atom Count53
Chiral Atom Count1
Bond Count52
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB07302 
Name9(S)-HODE
Groups experimental
Synonyms
  • 9(S)-HODE
  • (9S,10E,12Z)-9-hydroxyoctadeca-10,12-dienoic acid
  • alpha-Dimorphecolic acid
  • 9S-Hode
CAS number73543-67-6

Drug Targets

NameTarget SequencePharmacological ActionActions
Peroxisome proliferator-activated receptor gammaMGETLGDSPIDPESDSFTDTLSANISQEMTMVDTEMPFWPTNFGISSVDL...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 5312830
ChEMBL CHEMBL1230670
ChEBI CHEBI:34496