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CHEBI:137469 - 12,13-epoxy-18-hydroxy-(9Z)-octadecenoate

ChEBI IDCHEBI:137469
ChEBI Name12,13-epoxy-18-hydroxy-(9Z)-octadecenoate
Stars
ASCII Name12,13-epoxy-18-hydroxy-(9Z)-octadecenoate
DefinitionAn octadecanoid anion that is the conjugate base of 18-hydroxy-12,13-epoxy-(9Z)-octadecenoic acid arising from deprotonation of the carboxylic acid function; major species at pH 7.3
Last Modified23 January 2023
Submitternhn
DownloadsMolfile
FormulaC18H31O4
Net Charge-1
Average Mass311.442
Monoisotopic Mass311.22278
SMILESO=C([O-])CCCCCCC/C=C\CC1OC1CCCCCO
InChIInChI=1S/C18H32O4/c19-15-11-7-9-13-17-16(22-17)12-8-5-3-1-2-4-6-10-14-18(20)21/h5,8,16-17,19H,1-4,6-7,9-15H2,(H,20,21)/p-1/b8-5-
InChIKeyQOUKBWWKBHWVNI-YVMONPNESA-M
ChEBI Ontology
Outgoing Relation(s)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) has functional parent vernolate (CHEBI:84026)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) is a epoxy fatty acid anion (CHEBI:190711)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) is a octadecanoid anion (CHEBI:131860)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) is a ω-hydroxy-long-chain fatty acid anion (CHEBI:140992)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) is conjugate base of 12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270)
Incoming Relation(s)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) is conjugate acid of 12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469)
IUPAC Name 
(9Z)-11-[3-(5-hydroxypentyl)oxiran-2-yl]undec-9-enoate
Synonym  Source
18,12(13)-HEpOME(1−)SUBMITTER
UniProt Name  Source
18-hydroxy-12,13-epoxy-(9Z)-octadecenoateUniProt
Citations