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CHEBI:132078 - N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate

ChEBI IDCHEBI:132078
ChEBI NameN-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate
Stars
ASCII NameN-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-gamma-aminobutyrate
DefinitionA monocarboxylic acid anion that is the conjugate base of N-[(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-icosatetraenoyl]-γ-aminobutanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified19 July 2016
Submitterlaimo
DownloadsMolfile
FormulaC24H38NO5
Net Charge-1
Average Mass420.570
Monoisotopic Mass420.27555
SMILESCCCCC[C@@H](/C=C/C=C\C/C=C\C/C=C\CCCC(=O)NCCCC(=O)[O-])OO
InChIInChI=1S/C24H39NO5/c1-2-3-13-17-22(30-29)18-14-11-9-7-5-4-6-8-10-12-15-19-23(26)25-21-16-20-24(27)28/h4-5,8-11,14,18,22,29H,2-3,6-7,12-13,15-17,19-21H2,1H3,(H,25,26)(H,27,28)/p-1/b5-4-,10-8-,11-9-,18-14+/t22-/m0/s1
InChIKeyMGNPEOZYWFYMNH-ORLNMRMGSA-M
ChEBI Ontology
Outgoing Relation(s)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078) is a N-acyl-γ-aminobutyrate (CHEBI:133575)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078) is a monocarboxylic acid anion (CHEBI:35757)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078) is a oxidized N-(fatty acyl)-γ-aminobutyrate(1−) (CHEBI:176568)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078) is conjugate base of N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747)
Incoming Relation(s)
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyric acid (CHEBI:132747) is conjugate acid of N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutyrate (CHEBI:132078)
IUPAC Name 
4-{[(5Z,8Z,11Z,13E,15S)-15-hydroperoxyicosa-5,8,11,13-tetraenoyl]amino}butanoate
Synonyms  Source
N-[15(S)-HPETE]-γ-aminobutanoateSUBMITTER
N-15-(S)-HPETE-GABA(1−)SUBMITTER
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-icosatetraenoyl]-γ-aminobutanoateSUBMITTER
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-eicosatetraenoyl]-γ-aminobutyrateChEBI
N-[15(S)-HPETE]-γ-aminobutyrateChEBI
N-[(12S)-hydroperoxy-(5Z,8Z,10E,14Z)-eicosatetraenoyl]-γ-aminobutanoateChEBI
UniProt Name  Source
N-(15S)-hydroperoxy-(5Z,8Z,11Z,13E)-eicosatetraenoyl-γ-aminobutanoateUniProt
Citations