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CHEBI:188915 - [7-(beta-D-Glucopyranosyloxy)-2-oxo-2H-chromen-4-yl]acetic acid

ChEBI IDCHEBI:188915
ChEBI Name[7-(beta-D-Glucopyranosyloxy)-2-oxo-2H-chromen-4-yl]acetic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18O10
Net Charge0
Average Mass382.321
Monoisotopic Mass382.09000
SMILESO=C(O)Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12
InChIInChI=1S/C17H18O10/c18-6-11-14(22)15(23)16(24)17(27-11)25-8-1-2-9-7(3-12(19)20)4-13(21)26-10(9)5-8/h1-2,4-5,11,14-18,22-24H,3,6H2,(H,19,20)/t11-,14-,15+,16-,17-/m1/s1
InChIKeyQFIOCPUZLBGHSQ-ZQOQDGPXSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
[7-(beta-D-Glucopyranosyloxy)-2-oxo-2H-chromen-4-yl]acetic acid (CHEBI:188915) is a coumarins (CHEBI:23403)
[7-(beta-D-Glucopyranosyloxy)-2-oxo-2H-chromen-4-yl]acetic acid (CHEBI:188915) is a glycoside (CHEBI:24400)
IUPAC Name 
2-[2-oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-yl]acetic acid
Manual XrefsDatabases
17600419ChemSpider