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CHEBI:144843 - (15S)-hydroperoxy-(11Z,13E)-icosadienoic acid

Default Structure
ChEBI IDCHEBI:144843
ChEBI Name(15S)-hydroperoxy-(11Z,13E)-icosadienoic acid
Stars
ASCII Name(15S)-hydroperoxy-(11Z,13E)-icosadienoic acid
DefinitionA hydroperoxy fatty acid that is (11Z,13E)-icosadienoic acid in which the pro-S hydrogen at position 15 has been replaced by a hydroperoxy group.
Last Modified24 January 2023
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H36O4
Net Charge0
Average Mass340.504
Monoisotopic Mass340.26136
SMILESCCCCC[C@@H](/C=C/C=C\CCCCCCCCCC(=O)O)OO
InChIInChI=1S/C20H36O4/c1-2-3-13-16-19(24-23)17-14-11-9-7-5-4-6-8-10-12-15-18-20(21)22/h9,11,14,17,19,23H,2-8,10,12-13,15-16,18H2,1H3,(H,21,22)/b11-9-,17-14+/t19-/m0/s1
InChIKeyKEXNVBSLXJLOPR-XMSPSUPSSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(15S)-hydroperoxy-(11Z,13E)-icosadienoic acid (CHEBI:144843) is a hydroperoxy polyunsaturated fatty acid (CHEBI:189832)
(15S)-hydroperoxy-(11Z,13E)-icosadienoic acid (CHEBI:144843) is a long-chain fatty acid (CHEBI:15904)
(15S)-hydroperoxy-(11Z,13E)-icosadienoic acid (CHEBI:144843) is conjugate acid of (15S)-hydroperoxy-(11Z,13E)-icosadienoate (CHEBI:144832)
Incoming Relation(s)
(15S)-hydroperoxy-(11Z,13E)-icosadienoate (CHEBI:144832) is conjugate base of (15S)-hydroperoxy-(11Z,13E)-icosadienoic acid (CHEBI:144843)
IUPAC Name 
(11Z,13E,15S)-15-hydroperoxyicosa-11,13-dienoic acid
Synonyms  Source
(11Z,13E,15S)-15-hydroperoxyeicosa-11,13-dienoic acidChEBI
(15S)-hydroperoxy-(11Z,13E)-eicosadienoic acidChEBI
15S-hydroperoxy-11Z,13E-eicosadienoic acidLIPID MAPS
15S-HpEDELIPID MAPS
Manual XrefsDatabases
LMFA01040030LIPID MAPS
Citations