CHEBI:132325 - 21-HDoHE

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 21-HDoHE
ChEBI ID CHEBI:132325
Definition A (ω−1)-hydroxy fatty acid that is (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoic acid substituted at position 21 by a hydroxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.489
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-21(23)19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22(24)25/h2,4-5,7-8,10-11,13-14,16-17,19,21,23H,3,6,9,12,15,18,20H2,1H3,(H,24,25)/b4-2-,7-5-,10-8-,13-11-,16-14-,19-17-
InChIKey IXAMNXQQWDOFMN-NZONWQNASA-N
SMILES C(C(O)=O)C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C(C)O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: PubMed
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): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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 21-HDoHE (CHEBI:132325) has functional parent all-cis-docosa-4,7,10,13,16,19-hexaenoic acid (CHEBI:28125)
21-HDoHE (CHEBI:132325) has role human xenobiotic metabolite (CHEBI:76967)
21-HDoHE (CHEBI:132325) has role mouse metabolite (CHEBI:75771)
21-HDoHE (CHEBI:132325) is a (ω−1)-hydroxy fatty acid (CHEBI:78954)
21-HDoHE (CHEBI:132325) is a hydroxydocosahexaenoic acid (CHEBI:72790)
21-HDoHE (CHEBI:132325) is conjugate acid of 21-HDoHE(1−) (CHEBI:132025)
Incoming 21-HDoHE(1−) (CHEBI:132025) is conjugate base of 21-HDoHE (CHEBI:132325)
IUPAC Name
(4Z,7Z,10Z,13Z,16Z,19Z)-21-hydroxydocosa-4,7,10,13,16,19-hexaenoic acid
Synonyms Sources
(4Z,7Z,10Z,13Z,16Z,19Z)-21-hydroxydocosahexaenoic acid ChEBI
21-HDHA ChEBI
21-hydroxy-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoic acid ChEBI
Registry Number Type Source
29189588 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
18577768 PubMed citation Europe PMC
19965612 PubMed citation Europe PMC
20506249 PubMed citation Europe PMC
26864527 PubMed citation Europe PMC
8577768 PubMed citation Europe PMC
Last Modified
30 June 2016