CHEBI:165769 - 12R-HODE

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 12R-HODE
ChEBI ID CHEBI:165769
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C18H32O3
Net Charge 0
Average Mass 296.451
Monoisotopic Mass 296.23514
InChI InChI=1S/C18H32O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h3-4,9,12,17,19H,2,5-8,10-11,13-16H2,1H3,(H,20,21)/b4-3-,12-9-/t17-/m1/s1
InChIKey OKIDIWHWTIMACU-MNEPGTOVSA-N
SMILES O[C@@H](C/C=C\CCCCCCCC(O)=O)CC/C=C\CC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 12R-HODE (CHEBI:165769) is a hydroxy fatty acid (CHEBI:24654)
12R-HODE (CHEBI:165769) is a octadecadienoic acid (CHEBI:25627)
IUPAC Name
(9Z,12R,15Z)-12-hydroxyoctadeca-9,15-dienoic acid
Manual Xrefs Databases
4472256 ChemSpider
LMFA01050112 LIPID MAPS
LMFA02000189 LIPID MAPS
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Registry Number Type Source
7121-47-3 CAS Registry Number ChemIDplus
Last Modified
23 February 2022