CHEBI:91137 - 17(R)-HDoHE

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ChEBI Name 17(R)-HDoHE
ChEBI ID CHEBI:91137
ChEBI ASCII Name 17(R)-HDoHE
Definition A polyunsaturated fatty acid that is (4Z,7Z,10Z,13Z,15E,19Z)-docosa-4,7,10,13,15,19-hexaenoic acid carrying a hydroxy substituent at the 17R-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000056874467
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Formula C22H32O3
Net Charge 0
Average Mass 344.489
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-2-3-15-18-21(23)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(24)25/h3,5-8,11-16,19,21,23H,2,4,9-10,17-18,20H2,1H3,(H,24,25)/b7-5-,8-6-,13-11-,14-12-,15-3-,19-16+/t21-/m1/s1
InChIKey SWTYBBUBEPPYCX-NGHKTGSUSA-N
SMILES C(CC/C=C\C/C=C\C/C=C\C/C=C\C=C\[C@@H](C/C=C\CC)O)(=O)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): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
(via (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid )
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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 17(R)-HDoHE (CHEBI:91137) has role human xenobiotic metabolite (CHEBI:76967)
17(R)-HDoHE (CHEBI:91137) has role mouse metabolite (CHEBI:75771)
17(R)-HDoHE (CHEBI:91137) is a (4Z,7Z,10Z,13Z,15E,19Z)-17-hydroxydocosahexaenoic acid (CHEBI:72637)
17(R)-HDoHE (CHEBI:91137) is conjugate acid of 17(R)-HDoHE(1−) (CHEBI:90814)
17(R)-HDoHE (CHEBI:91137) is enantiomer of 17(S)-HDoHE (CHEBI:138640)
Incoming 17(R)-HDoHE(1−) (CHEBI:90814) is conjugate base of 17(R)-HDoHE (CHEBI:91137)
17(S)-HDoHE (CHEBI:138640) is enantiomer of 17(R)-HDoHE (CHEBI:91137)
IUPAC Name
(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoic acid
Synonyms Sources
(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroxydocosahexaenoic acid ChEBI
17R-HDHA LIPID MAPS
17R-hydroxy-4Z,7Z,10Z,13Z,15E,19Z-docosahexaenoic acid LIPID MAPS
Manual Xrefs Databases
CPD-17452 MetaCyc
LMFA04000072 LIPID MAPS
View more database links
Registry Number Type Source
14339387 Reaxys Registry Number Reaxys
Citations Types Sources
12391014 PubMed citation Europe PMC
21724996 PubMed citation Europe PMC
27860453 PubMed citation Europe PMC
Last Modified
16 October 2019