CHEBI:72647 - 14-HDoHE

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ChEBI Name 14-HDoHE
ChEBI ID CHEBI:72647
Definition A hydroxydocosahexaenoic acid that consists of (4Z,7Z,10Z,12E,16Z,19Z)-docosahexaenoic acid bearing an additional 14-hydroxy substituent.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C22H32O3
Net Charge 0
Average Mass 344.489
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-2-3-4-5-12-15-18-21(23)19-16-13-10-8-6-7-9-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+
InChIKey ZNEBXONKCYFJAF-BGKMTWLOSA-N
SMILES C(C(O)=O)C/C=C\C/C=C\C\C=C/C=C/C(C/C=C\C/C=C\CC)O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) 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 xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via hydroxydocosahexaenoic acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 14-HDoHE (CHEBI:72647) has role human xenobiotic metabolite (CHEBI:76967)
14-HDoHE (CHEBI:72647) is a hydroxydocosahexaenoic acid (CHEBI:72790)
14-HDoHE (CHEBI:72647) is a secondary allylic alcohol (CHEBI:134396)
14-HDoHE (CHEBI:72647) is conjugate acid of 14-HDoHE(1−) (CHEBI:90866)
Incoming (14R)-HDoHE (CHEBI:137346) is a 14-HDoHE (CHEBI:72647)
(14S)-HDoHE (CHEBI:137347) is a 14-HDoHE (CHEBI:72647)
14-HDoHE(1−) (CHEBI:90866) is conjugate base of 14-HDoHE (CHEBI:72647)
IUPAC Name
(4Z,7Z,10Z,12E,16Z,19Z)-14-hydroxydocosa-4,7,10,12,16,19-hexaenoic acid
Synonyms Sources
(+/-)-14-HDoHE LIPID MAPS
(+/-)-14-hydroxy-4Z,7Z,10Z,12E,16Z,19Z-docosahexaenoic acid LIPID MAPS
Manual Xref Database
LMFA04000030 LIPID MAPS
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Citation Waiting for Citations Type Source
25586183 PubMed citation Europe PMC
Last Modified
07 June 2017