CHEBI:78860 - 12(S)-HPE(8,10,14)TrE

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ChEBI Name 12(S)-HPE(8,10,14)TrE
ChEBI ID CHEBI:78860
ChEBI ASCII Name 12(S)-HPE(8,10,14)TrE
Definition A hydroperoxy fatty acid that is (8Z,10E,14Z)-icosatrienoic acid in which the hydroperoxy group is located at the 12(S)-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H34O4
Net Charge 0
Average Mass 338.48160
Monoisotopic Mass 338.24571
InChI InChI=1S/C20H34O4/c1-2-3-4-5-10-13-16-19(24-23)17-14-11-8-6-7-9-12-15-18-20(21)22/h8,10-11,13-14,17,19,23H,2-7,9,12,15-16,18H2,1H3,(H,21,22)/b11-8-,13-10-,17-14+/t19-/m0/s1
InChIKey CZOASFIZEHMKCK-ONNNWOQGSA-N
SMILES CCCCC\C=C/C[C@H](OO)\C=C\C=C/CCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 12(S)-HPE(8,10,14)TrE (CHEBI:78860) has functional parent all-cis-icosa-8,11,14-trienoic acid (CHEBI:53486)
12(S)-HPE(8,10,14)TrE (CHEBI:78860) is a 12-HPE(8,10,14)TrE (CHEBI:84174)
12(S)-HPE(8,10,14)TrE (CHEBI:78860) is conjugate acid of 12(S)-HPE(8,10,14)TrE(1−) (CHEBI:78047)
Incoming 12(S)-HPE(8,10,14)TrE(1−) (CHEBI:78047) is conjugate base of 12(S)-HPE(8,10,14)TrE (CHEBI:78860)
IUPAC Name
(8Z,10E,12S,14Z)-12-hydroperoxyicosa-8,10,14-trienoic acid
Synonyms Sources
(8Z,10E,12S,14Z)-hydroperoxyeicosatrienoic acid ChEBI
(8Z,10E,12S,14Z)-hydroperoxyicosatrienoic acid ChEBI
Last Modified
06 January 2015