EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:176388 - Epoxy-hydroxy-octadecenoic acid

Default Structure
ChEBI IDCHEBI:176388
ChEBI NameEpoxy-hydroxy-octadecenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCC/C=C\[C@@H]1O[C@H]1[C@@H](O)CCCCCCCC(=O)O
InChIInChI=1S/C18H32O4/c1-2-3-4-6-10-13-16-18(22-16)15(19)12-9-7-5-8-11-14-17(20)21/h10,13,15-16,18-19H,2-9,11-12,14H2,1H3,(H,20,21)/b13-10-/t15-,16-,18-/m0/s1
InChIKeyNFFSPFJIYOTZQX-ZSNSXZSMSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) leaf (BTO:0000713) MetaboLights (MTBLS2566)
ChEBI Ontology
Outgoing Relation(s)
Epoxy-hydroxy-octadecenoic acid (CHEBI:176388) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(9S)-9-[(2S,3S)-3-[(Z)-hept-1-enyl]oxiran-2-yl]-9-hydroxynonanoic acid
Manual XrefsDatabases
17220732ChemSpider
LMFA02000010LIPID MAPS