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(Q105217498)
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English
2-(3,4-Dihydroxyphenyl)-3-[(3-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-7-methoxy-4H-1-benzopyran-4-one
group of stereoisomers with the chemical formula C₂₈H₃₂O₁₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavone
1 reference
inferred from
flavone
mass
640.1639495639998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₃₂O₁₇
0 references
canonical SMILES
O=C1C(OC2OC(CO)C(O)C(OC3OC(CO)C(O)C(O)C3O)C2O)=C(OC4=CC(OC)=CC(O)=C14)C=5C=CC(O)=C(O)C5
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Identifiers
InChI
InChI=1S/C28H32O17/c1-40-10-5-13(33)17-14(6-10)41-24(9-2-3-11(31)12(32)4-9)26(20(17)36)45-28-23(39)25(19(35)16(8-30)43-28)44-27-22(38)21(37)18(34)15(7-29)42-27/h2-6,15-16,18-19,21-23,25,27-35,37-39H,7-8H2,1H3
0 references
InChIKey
QAKZPBCOTDXPHA-UHFFFAOYSA-N
0 references
PubChem CID
74978387
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QAKZPBCOTDXPHA-UHFFFAOYSA-N
UniChem compound ID
31997783
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0031655
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QAKZPBCOTDXPHA-UHFFFAOYSA-N
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