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12(S)-HETE(1-)
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http://purl.obolibrary.org/obo/CHEBI_90680
An icosanoid anion that is the conjugate base of 12(S)-HETE, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Term info
Label
12(S)-HETE(1-)
Synonyms
- (5Z,8Z,10E,12S,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoate
Subsets
3_STAR
charge
-1
formula
C20H31O3
has obo namespace
chebi_ontology
has related synonym
(12S)-hydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoate
id
CHEBI:90680
inchi
InChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/p-1/b9-7-,11-8-,13-10-,17-14+/t19-/m0/s1
inchikey
ZNHVWPKMFKADKW-LQWMCKPYSA-M
mass
319.459
monoisotopicmass
319.22787
smiles
C(=C\[C@H](C/C=C\CCCCC)O)/C=C\C/C=C\CCCC(=O)[O-]
Term relations
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