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CHEBI:168341 - 10-Acetoxyoleuropein

ChEBI IDCHEBI:168341
ChEBI Name10-Acetoxyoleuropein
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H34O15
Net Charge0
Average Mass598.554
Monoisotopic Mass598.18977
SMILESCOC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)/C(=C/COC(C)=O)C1CC(=O)OCCc1ccc(O)c(O)c1
InChIInChI=1S/C27H34O15/c1-13(29)38-8-6-15-16(10-21(32)39-7-5-14-3-4-18(30)19(31)9-14)17(25(36)37-2)12-40-26(15)42-27-24(35)23(34)22(33)20(11-28)41-27/h3-4,6,9,12,16,20,22-24,26-28,30-31,33-35H,5,7-8,10-11H2,1-2H3/b15-6+
InChIKeyYLCGBFYGDVDQTI-GIDUJCDVSA-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)
10-Acetoxyoleuropein (CHEBI:168341) is a terpene glycoside (CHEBI:61777)
IUPAC Name 
methyl (5E)-5-(2-acetyloxyethylidene)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
Manual XrefsDatabases
HMDB0035216HMDB