EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:18471 - (−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside

ChEBI IDCHEBI:18471
ChEBI Name(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside
Stars
ASCII Name(-)-11-hydroxy-9,10-dihydrojasmonic acid 11-beta-D-glucoside
DefinitionA monosaccharide derivative that is (−)-11-hydroxy-9,10-dihydrojasmonic acid attached to a β-D-glucopyranosyl residue at position 11 via a glycosidic linkage.
Last Modified9 March 2015
DownloadsMolfile
FormulaC18H30O9
Net Charge0
Average Mass390.429
Monoisotopic Mass390.18898
SMILESCC(CCC[C@H]1C(=O)CC[C@@H]1CC(=O)O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C18H30O9/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/h9-11,13,15-19,23-25H,2-8H2,1H3,(H,21,22)/t9?,10-,11-,13-,15-,16+,17-,18-/m1/s1
InChIKeyQPYZJXJBZOQDGA-XGNCEZCHSA-N
Species of MetaboliteComponentSourceComments
Centella asiatica (ncbitaxon:48106) - MetaboLights (MTBLS175)
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
jasmonates  The jasmonates (JAs) are a group of plant hormones which help regulate plant growth and development.
ChEBI Ontology
Outgoing Relation(s)
(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside (CHEBI:18471) has functional parent (−)-11-hydroxy-9,10-dihydrojasmonic acid (CHEBI:38152)
(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside (CHEBI:18471) has role plant metabolite (CHEBI:76924)
(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside (CHEBI:18471) is a dihydrojasmonic acid (CHEBI:23747)
(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside (CHEBI:18471) is a monosaccharide derivative (CHEBI:63367)
(−)-11-hydroxy-9,10-dihydrojasmonic acid 11-β-D-glucoside (CHEBI:18471) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
{(1R,2R)-2-[4-(β-D-glucopyranosyloxy)pentyl]-3-oxocyclopentyl}acetic acid
Registry NumbersSources
Reaxys:6985377Reaxys