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CHEBI:63331 - 9(R)-HPODE

ChEBI IDCHEBI:63331
ChEBI Name9(R)-HPODE
Stars
ASCII Name9(R)-HPODE
DefinitionAn HPODE (hydroperoxy-octadecadienoic acid) in which the double bonds are at positions 10 and 12 (E and Z geometry, respectively) and the hydroperoxy group is at position 9 (R configuration).
Last Modified8 December 2011
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESCCCCC/C=C\C=C\[C@@H](CCCCCCCC(=O)O)OO
InChIInChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b8-6-,14-11+/t17-/m0/s1
InChIKeyJGUNZIWGNMQSBM-WXUVIADPSA-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(R)-HPODE (CHEBI:63331) has functional parent (10E,12Z)-octadecadienoic acid (CHEBI:44526)
9(R)-HPODE (CHEBI:63331) is a HPODE (CHEBI:36329)
9(R)-HPODE (CHEBI:63331) is conjugate acid of 9(R)-HPODE(1−) (CHEBI:63323)
9(R)-HPODE (CHEBI:63331) is enantiomer of 9(S)-HPODE (CHEBI:34498)
Incoming Relation(s)
9(R)-HPODE(1−) (CHEBI:63323) is conjugate base of 9(R)-HPODE (CHEBI:63331)
9(S)-HPODE (CHEBI:34498) is enantiomer of 9(R)-HPODE (CHEBI:63331)
IUPAC Name 
(9R,10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoic acid
Synonyms  Source
(9R,10E,12Z)-9-hydroperoxy-10,12-octadecadienoic acidChEBI
9(R)-HpODEChEBI
Registry NumbersSources
Reaxys:18880808Reaxys
Citations