9,10,13-TriHOME (CHEBI:34499)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	9,10,13-TriHOME

ChEBI ID	CHEBI:34499

Definition	A TriHOME that is (11E)-octadec-11-enoic acid in which the three hydroxy substituents are located at positions 9, 10 and 13.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	No supplier information found for this compound.

Download	Molfile XML SDF

more structures >>

Formula

C18H34O5

Net Charge

Average Mass

330.460

Monoisotopic Mass

330.24062

InChI

InChI=1S/C18H34O5/c1-2-3-7-10-15(19)13-14-17(21)16(20)11-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+

InChIKey

NTVFQBIHLSPEGQ-BUHFOSPRSA-N

SMILES

C(C(CCCCCCCC(O)=O)O)(/C=C/C(CCCCC)O)O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	See: MetaboLights Study
Homo sapiens (NCBI:txid9606)	Found in blood (UBERON:0000178). See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	human blood serum metabolite Any metabolite (endogenous or exogenous) found in human blood serum samples. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via TriHOME )

ChEBI Ontology
Outgoing	9,10,13-TriHOME (CHEBI:34499) has role human blood serum metabolite (CHEBI:85234) 9,10,13-TriHOME (CHEBI:34499) is a long-chain fatty acid (CHEBI:15904) 9,10,13-TriHOME (CHEBI:34499) is a monounsaturated fatty acid (CHEBI:25413) 9,10,13-TriHOME (CHEBI:34499) is a straight-chain fatty acid (CHEBI:59202) 9,10,13-TriHOME (CHEBI:34499) is a TriHOME (CHEBI:73765)

IUPAC Name

(11E)-9,10,13-trihydroxyoctadec-11-enoic acid

Synonyms	Sources
(11E)-9,10,13-trihydroxyoctadecenoic acid	ChEBI
(E)-9,10,13-Trihydroxy-11-octadecenoic acid	ChemIDplus
9,10,13-TriHOME	KEGG COMPOUND
9,10,13-trihydroxy-11-octadecenoic acid	LIPID MAPS
9,10,13-Trihydroxyoctadec-11-enoic acid	KEGG COMPOUND

Citation	Type	Source
21359215	PubMed citation	Europe PMC

Last Modified

08 June 2016