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CHEBI:39541 - (TRANS-12,13-EPOXY)-11-HYDROXY-9(Z)-OCTADECENOIC ACID

Default Structure
ChEBI IDCHEBI:39541
ChEBI Name(TRANS-12,13-EPOXY)-11-HYDROXY-9(Z)-OCTADECENOIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILES[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])/C([H])=C(/[H])[C@]([H])(O[H])[C@@]1([H])O[C@]1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]
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)/b12-10-/t15-,16+,18+/m0/s1
InChIKeyUZCLYICSWADYGM-RXWDXHPSSA-N
ChEBI Ontology
Outgoing Relation(s)
(TRANS-12,13-EPOXY)-11-HYDROXY-9(Z)-OCTADECENOIC ACID (CHEBI:39541) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(9Z,11S)-11-hydroxy-11-[(2R,3R)-3-pentyloxiran-2-yl]undec-9-enoic acidPDBeChem
(TRANS-12,13-EPOXY)-11-HYDROXY-9(Z)-OCTADECENOIC ACIDPDBeChem
Manual XrefsDatabases
11OPDBeChem