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CHEBI:132064 - 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−)

ChEBI IDCHEBI:132064
ChEBI Name11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−)
Stars
ASCII Name11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1-)
DefinitionA monounsaturated fatty acid anion that is the conjugate base of 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified18 July 2016
Submitternhn
DownloadsMolfile
FormulaC18H31O4
Net Charge-1
Average Mass311.442
Monoisotopic Mass311.22278
SMILESCCCCC[C@@H]1O[C@H]1C(O)/C=C\CCCCCCCC(=O)[O-]
InChIInChI=1S/C18H32O4/c1-2-3-9-13-16-18(22-16)15(19)12-10-7-5-4-6-8-11-14-17(20)21/h10,12,15-16,18-19H,2-9,11,13-14H2,1H3,(H,20,21)/p-1/b12-10-/t15?,16-,18-/m0/s1
InChIKeyUZCLYICSWADYGM-VHIAHCGJSA-M
ChEBI Ontology
Outgoing Relation(s)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is a (9Z)-11-hydroxy-12,13-epoxyoctadecenoate(1−) (CHEBI:194353)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is a hydroxy fatty acid anion (CHEBI:59835)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is a long-chain fatty acid anion (CHEBI:57560)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is a monounsaturated fatty acid anion (CHEBI:82680)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is a octadecanoid anion (CHEBI:131860)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064) is conjugate base of 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoic acid (CHEBI:132678)
Incoming Relation(s)
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoic acid (CHEBI:132678) is conjugate acid of 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1−) (CHEBI:132064)
IUPAC Name 
(9Z)-11-hydroxy-11-[(2S,3S)-3-pentyloxiran-2-yl]undec-9-enoate
UniProt Name  Source
11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoateUniProt
Citations