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CHEBI:168202 - Methylpicraquassioside A

ChEBI IDCHEBI:168202
ChEBI NameMethylpicraquassioside A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O10
Net Charge0
Average Mass412.391
Monoisotopic Mass412.13695
SMILESCOC(=O)CCc1c(OC2OC(CO)C(O)C(O)C2O)cc2occc2c1OC
InChIInChI=1S/C19H24O10/c1-25-14(21)4-3-9-12(7-11-10(5-6-27-11)18(9)26-2)28-19-17(24)16(23)15(22)13(8-20)29-19/h5-7,13,15-17,19-20,22-24H,3-4,8H2,1-2H3
InChIKeyYCIAHAYEVBEGKT-UHFFFAOYSA-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)
Methylpicraquassioside A (CHEBI:168202) is a glycoside (CHEBI:24400)
IUPAC Name 
methyl 3-[4-methoxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzouran-5-yl]propanoate
Manual XrefsDatabases
HMDB0038347HMDB