CHEBI:84027 - 9,10-DiHOME(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 9,10-DiHOME(1−)
ChEBI ID CHEBI:84027
ChEBI ASCII Name 9,10-DiHOME(1-)
Definition A monounsaturated fatty acid anion that is the conjugate base of 9,10-DiHOME, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C18H33O4
Net Charge -1
Average Mass 313.45280
Monoisotopic Mass 313.23843
InChI InChI=1S/C18H34O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h7,10,16-17,19-20H,2-6,8-9,11-15H2,1H3,(H,21,22)/p-1/b10-7-
InChIKey XEBKSQSGNGRGDW-YFHOEESVSA-M
SMILES CCCCC\C=C/CC(O)C(O)CCCCCCCC([O-])=O
ChEBI Ontology
Outgoing 9,10-DiHOME(1−) (CHEBI:84027) is a hydroxy monounsaturated fatty acid anion (CHEBI:131870)
9,10-DiHOME(1−) (CHEBI:84027) is a long-chain fatty acid anion (CHEBI:57560)
9,10-DiHOME(1−) (CHEBI:84027) is conjugate base of 9,10-DiHOME (CHEBI:72663)
Incoming 9,10-DiHOME (CHEBI:72663) is conjugate acid of 9,10-DiHOME(1−) (CHEBI:84027)
IUPAC Name
(12Z)-9,10-dihydroxyoctadec-12-enoate
Synonyms Sources
(12Z)-9,10-dihydroxyoctadecenoate SUBMITTER
9,10-dihydroxy-(12Z)-octadecenoate UniProt
Last Modified
09 June 2016