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CHEBI:168518 - Oleuroside

ChEBI IDCHEBI:168518
ChEBI NameOleuroside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H32O13
Net Charge0
Average Mass540.518
Monoisotopic Mass540.18429
SMILESC=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc(O)c(O)c1
InChIInChI=1S/C25H32O13/c1-3-13-14(9-19(29)35-7-6-12-4-5-16(27)17(28)8-12)15(23(33)34-2)11-36-24(13)38-25-22(32)21(31)20(30)18(10-26)37-25/h3-5,8,11,13-14,18,20-22,24-28,30-32H,1,6-7,9-10H2,2H3
InChIKeyWWKVQWHAWPZZDB-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)
Oleuroside (CHEBI:168518) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
methyl 4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-3-ethenyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate
Manual XrefsDatabases
HMDB0035352HMDB