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CHEBI:229194 - Protoanemonin hydrate glucoside

ChEBI IDCHEBI:229194
ChEBI NameProtoanemonin hydrate glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O8
Net Charge0
Average Mass276.241
Monoisotopic Mass276.08452
SMILESCC1(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=CC(=O)O1
InChIInChI=1S/C11H16O8/c1-11(3-2-6(13)18-11)19-10-9(16)8(15)7(14)5(4-12)17-10/h2-3,5,7-10,12,14-16H,4H2,1H3/t5-,7-,8+,9-,10+,11?/m1/s1
InChIKeyJZQKZQUAXUPXEV-YMBNTVGMSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Protoanemonin hydrate glucoside (CHEBI:229194) is a glycoside (CHEBI:24400)
IUPAC Name 
5-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyuran-2-one
Manual XrefsDatabases
10142634ChemSpider