CHEBI:39573 - (13R)-HPODE

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ChEBI Name (13R)-HPODE
ChEBI ID CHEBI:39573
ChEBI ASCII Name (13R)-HPODE
Definition The (R)-enantiomer of 13-HPODE
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H32O4
Net Charge 0
Average Mass 312.445
Monoisotopic Mass 312.23006
InChI InChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,12,15,17,21H,2-6,8,10-11,13-14,16H2,1H3,(H,19,20)/b9-7-,15-12+/t17-/m1/s1
InChIKey JDSRHVWSAMTSSN-PIHGWCCBSA-N
SMILES C(CCCCCCC/C=C\C=C\[C@@H](CCCCC)OO)(=O)O
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 13-HPODE )
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ChEBI Ontology
Outgoing (13R)-HPODE (CHEBI:39573) has functional parent octadeca-9,11-dienoic acid (CHEBI:36025)
(13R)-HPODE (CHEBI:39573) is a 13-HPODE (CHEBI:91272)
(13R)-HPODE (CHEBI:39573) is conjugate acid of 13(R)-HPODE(1−) (CHEBI:133985)
(13R)-HPODE (CHEBI:39573) is enantiomer of 13(S)-HPODE (CHEBI:15655)
Incoming 13(R)-HPODE(1−) (CHEBI:133985) is conjugate base of (13R)-HPODE (CHEBI:39573)
13(S)-HPODE (CHEBI:15655) is enantiomer of (13R)-HPODE (CHEBI:39573)
IUPAC Name
(9Z,11E,13R)-13-hydroperoxyoctadeca-9,11-dienoic acid
Synonym Source
(9Z,11E,13R)-13-hydroperoxyoctadecadienoic acid ChEBI
Manual Xref Database
13R PDBeChem
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Citations Waiting for Citations Types Sources
23233731 PubMed citation Europe PMC
26113537 PubMed citation Europe PMC
Last Modified
20 March 2017