CHEBI:68946 - alpha-dimorphecolic acid

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ChEBI Name alpha-dimorphecolic acid
ChEBI ID CHEBI:68946
Definition A natural product found in Carthamus oxyacantha.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H32O3
Net Charge 0
Average Mass 296.44490
Monoisotopic Mass 296.23514
InChI InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+
InChIKey NPDSHTNEKLQQIJ-ZJHFMPGASA-N
SMILES CCCCC\C=C/C=C/C(O)CCCCCCCC(O)=O
Metabolite of Species Details
Carthamus oxyacantha (NCBI:txid122010) Found in aerial part (BTO:0001658). Crude ethanolic extract of aerial parts 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): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing alpha-dimorphecolic acid (CHEBI:68946) has role metabolite (CHEBI:25212)
alpha-dimorphecolic acid (CHEBI:68946) is a octadecadienoic acid (CHEBI:25627)
Synonyms Sources
(+/-)-9-HODE ChEBI
(10E,12Z)-9-Hydroxyoctadeca-10,12-dienoic acid ChEBI
9-hydroxy-trans-10,cis-12-octadecadienoic acid ChEBI
Manual Xref Database
HMDB0062652 HMDB
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Citation Waiting for Citations Type Source
22060189 PubMed citation Europe PMC
Last Modified
24 February 2022
General Comment
2014-10-17 Suggested Classification: ISA:long-chain fatty acid(CHEBI:15904); ISA:hydroxy fatty acid(CHEBI:24654); ISA:unsaturated fatty acid(CHEBI:27208); ISA:secondary alcohol(CHEBI:35681); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:carboxylic acid(CHEBI:33575); ISA:carbonyl compound(CHEBI:36586);