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CHEBI:132022 - 12-hydroxyjasmonate

ChEBI IDCHEBI:132022
ChEBI Name12-hydroxyjasmonate
Stars
DefinitionA 5-oxo monocarboxylic acid anion that is the conjugate base of 12-hydroxyjasmonic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified4 July 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H17O4
Net Charge-1
Average Mass225.264
Monoisotopic Mass225.11323
SMILESO=C([O-])C[C@H]1CCC(=O)[C@@H]1C/C=C\CCO
InChIInChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)/p-1/b2-1-/t9-,10-/m1/s1
InChIKeyRZGFUGXQKMEMOO-BSANDHCLSA-M
ChEBI Ontology
Outgoing Relation(s)
12-hydroxyjasmonate (CHEBI:132022) has functional parent jasmonate(1−) (CHEBI:58431)
12-hydroxyjasmonate (CHEBI:132022) is a 12-hydroxyjasmonates (CHEBI:136810)
12-hydroxyjasmonate (CHEBI:132022) is conjugate base of 12-hydroxyjasmonic acid (CHEBI:37420)
Incoming Relation(s)
12-hydroxyjasmonic acid (CHEBI:37420) is conjugate acid of 12-hydroxyjasmonate (CHEBI:132022)
IUPAC Name 
{(1R,2R)-2-[(2Z)-5-hydroxypent-2-en-1-yl]-3-oxocyclopentyl}acetate
UniProt Name  Source
(1R,2R)-12-hydroxyjasmonateUniProt
Manual XrefsDatabases
CPD-11253MetaCyc
Citations