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CHEBI:169743 - beta-D-Glucopyranosyl-11-hydroxyjasmonic acid

ChEBI IDCHEBI:169743
ChEBI Namebeta-D-Glucopyranosyl-11-hydroxyjasmonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O9
Net Charge0
Average Mass388.413
Monoisotopic Mass388.17333
SMILESCC(/C=C/CC1C(=O)CCC1CC(=O)O)OC1OC(CO)C(O)C(O)C1O
InChIInChI=1S/C18H28O9/c1-9(26-18-17(25)16(24)15(23)13(8-19)27-18)3-2-4-11-10(7-14(21)22)5-6-12(11)20/h2-3,9-11,13,15-19,23-25H,4-8H2,1H3,(H,21,22)/b3-2+
InChIKeyLAYQBSCEPAXXNJ-NSCUHMNNSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
beta-D-Glucopyranosyl-11-hydroxyjasmonic acid (CHEBI:169743) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
2-[3-oxo-2-[(E)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetic acid
Manual XrefsDatabases
HMDB0039964HMDB