CHEBI:136401 - 14(R),15(S)-DiHPETE

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ChEBI Name 14(R),15(S)-DiHPETE
ChEBI ID CHEBI:136401
ChEBI ASCII Name 14(R),15(S)-DiHPETE
Definition A bis(hydroperoxy)icosatetraenoic acid that is (5Z,8Z,10E,12E)-icosatetraenoic acid carrying two hydroperoxy substituents at positions 14 and 15 (the 14R,15S-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H32O6
Net Charge 0
Average Mass 368.465
Monoisotopic Mass 368.21989
InChI InChI=1S/C20H32O6/c1-2-3-12-15-18(25-23)19(26-24)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6-10,13,16,18-19,23-24H,2-3,5,11-12,14-15,17H2,1H3,(H,21,22)/b6-4-,9-7-,10-8+,16-13+/t18-,19+/m0/s1
InChIKey USYFDKIQMRDNHC-PEPUZGFWSA-N
SMILES OC(CCC/C=C\C\C=C/C=C/C=C/[C@H]([C@H](CCCCC)OO)OO)=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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 14(R),15(S)-DiHPETE (CHEBI:136401) has role human xenobiotic metabolite (CHEBI:76967)
14(R),15(S)-DiHPETE (CHEBI:136401) is a bis(hydroperoxy)icosatetraenoic acid (CHEBI:138293)
14(R),15(S)-DiHPETE (CHEBI:136401) is conjugate acid of 14(R),15(S)-DiHPETE(1−) (CHEBI:133900)
Incoming 14(R),15(S)-DiHPETE(1−) (CHEBI:133900) is conjugate base of 14(R),15(S)-DiHPETE (CHEBI:136401)
IUPAC Name
(5Z,8Z,10E,12E,14R,15S)-14,15-bis(hydroperoxy)icosa-5,8,10,12-tetraenoic acid
Synonyms Sources
(14R,15S)-DiHPETE ChEBI
(14R,15S)-dihydroperoxy-(5Z,8Z,10E,12E)-eicosatetraenoic acid ChEBI
(14R,15S)-dihydroperoxy-(5Z,8Z,10E,12E)-icosatetraenoic acid ChEBI
(5Z,8Z,10E,12E,14R,15S)-14,15-bis(hydroperoxy)eicosatetraenoic acid ChEBI
(5Z,8Z,10E,12E,14R,15S)-14,15-bis(hydroperoxy)icosatetraenoic acid ChEBI
Citations Waiting for Citations Types Sources
2774560 PubMed citation Europe PMC
8334154 PubMed citation Europe PMC
Last Modified
17 February 2022