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CHEBI:138270 - 12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid

ChEBI IDCHEBI:138270
ChEBI Name12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid
Stars
ASCII Name12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid
DefinitionAn octadecanoid that is 12,13-epoxy-(9Z)-octadecenoic acid carrying an additional hydroxy substituent at position 18.
Last Modified24 January 2023
SubmitterSteve
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
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)/b8-5-
InChIKeyQOUKBWWKBHWVNI-YVMONPNESA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) has functional parent linoleic acid (CHEBI:17351)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) is a epoxy fatty acid (CHEBI:61498)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) is a octadecanoid (CHEBI:36326)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) is a ω-hydroxy-long-chain fatty acid (CHEBI:140997)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270) is conjugate acid of 12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469)
Incoming Relation(s)
12,13-epoxy-18-hydroxy-(9Z)-octadecenoate (CHEBI:137469) is conjugate base of 12,13-epoxy-18-hydroxy-(9Z)-octadecenoic acid (CHEBI:138270)
IUPAC Name 
(9Z)-11-[3-(5-hydroxypentyl)oxiran-2-yl]undec-9-enoic acid
Synonyms  Source
18-hydroxy-12,13-epoxy-(9Z)-octadecenoic acidChEBI
18,12(13)-HEpOMEChEBI
Citations