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CHEBI:34495 - 9(S)-HETE

ChEBI IDCHEBI:34495
ChEBI Name9(S)-HETE
Stars
ASCII Name9(S)-HETE
DefinitionA HETE having a (9S)-hydroxy group and (5Z)-, (7E)-, (11Z)- and (14Z)-double bonds.
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H32O3
Net Charge0
Average Mass320.473
Monoisotopic Mass320.23514
SMILESCCCCC/C=C\C/C=C\C[C@H](O)/C=C/C=C\CCCC(=O)O
InChIInChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-10-13-16-19(21)17-14-11-9-12-15-18-20(22)23/h6-7,9-11,13-14,17,19,21H,2-5,8,12,15-16,18H2,1H3,(H,22,23)/b7-6-,11-9-,13-10-,17-14+/t19-/m0/s1
InChIKeyKATOYYZUTNAWSA-VBLHFSPLSA-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)
9(S)-HETE (CHEBI:34495) has functional parent icosa-5,7,11,14-tetraenoic acid (CHEBI:36232)
9(S)-HETE (CHEBI:34495) is a HETE (CHEBI:36275)
IUPAC Name 
(5Z,7E,9S,11Z,14Z)-9-hydroxyicosa-5,7,11,14-tetraenoic acid
Synonyms  Source
9(S)-HETEKEGG COMPOUND
(5Z,7E,11Z,14Z)-(9S)-9-Hydroxyeicosa-5,7,11,14-tetraenoic acidKEGG COMPOUND
(5Z,7E,11Z,14Z)-(9S)-9-Hydroxyicosa-5,7,11,14-tetraenoic acidKEGG COMPOUND
9S-HETELIPID MAPS
(S)-(Z,E,Z,Z)-9-hydroxyicosa-5,7,11,14-tetraenoic acidChEBI
9(S)-hydroxyeicosatetraenoic acidChEBI
Manual XrefsDatabases
C14779KEGG COMPOUND
LMFA03060027LIPID MAPS
C00000420KNApSAcK
Registry NumbersSources
Reaxys:8227260Reaxys
CAS:107656-13-3KEGG COMPOUND