CHEBI:90814 - 17(R)-HDoHE(1−)

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ChEBI Name 17(R)-HDoHE(1−)
ChEBI ID CHEBI:90814
ChEBI ASCII Name 17(R)-HDoHE(1-)
Definition A hydroxy polyunsaturated fatty acid anion that is the conjugate base of 17(R)-HDoHE arising from deprotonation of the carboxylic acid function; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
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Formula C22H31O3
Net Charge -1
Average Mass 343.481
Monoisotopic Mass 343.22787
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)/p-1/b7-5-,8-6-,13-11-,14-12-,15-3-,19-16+/t21-/m1/s1
InChIKey SWTYBBUBEPPYCX-NGHKTGSUSA-M
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
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 17(R)-HDoHE(1−) (CHEBI:90814) has role human xenobiotic metabolite (CHEBI:76967)
17(R)-HDoHE(1−) (CHEBI:90814) has role mouse metabolite (CHEBI:75771)
17(R)-HDoHE(1−) (CHEBI:90814) is a hydroxy fatty acid anion (CHEBI:59835)
17(R)-HDoHE(1−) (CHEBI:90814) is a hydroxydocosahexaenoate (CHEBI:131867)
17(R)-HDoHE(1−) (CHEBI:90814) is a long-chain fatty acid anion (CHEBI:57560)
17(R)-HDoHE(1−) (CHEBI:90814) is a polyunsaturated fatty acid anion (CHEBI:76567)
17(R)-HDoHE(1−) (CHEBI:90814) is conjugate base of 17(R)-HDoHE (CHEBI:91137)
Incoming 17(R)-HDoHE (CHEBI:91137) is conjugate acid of 17(R)-HDoHE(1−) (CHEBI:90814)
IUPAC Name
(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroxydocosa-4,7,10,13,15,19-hexaenoate
Synonyms Sources
(4Z,7Z,10Z,13Z,15E,17R,19Z)-17-hydroxydocosahexaenoate ChEBI
17R-HDHA(1−) SUBMITTER
17R-hydroxy-(4Z,7Z,10Z,13Z,15E,19Z)-docosahexaenoate UniProt
Manual Xref Database
CPD-17452 MetaCyc
View more database links
Citation Waiting for Citations Type Source
12391014 PubMed citation SUBMITTER
Last Modified
10 February 2016