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(Q105221155)
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English
2-[5-(3,7-dihydroxy-5-oxochromen-2-yl)-2,3-dihydroxyphenoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl 3,4,5-trihydroxybenzoate
group of stereoisomers with the chemical formula C₂₈H₂₄O₁₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavylium compound
1 reference
inferred from
flavylium compound
mass
616.106434688
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₈H₂₄O₁₆
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canonical SMILES
O=C(OC1C(O)C(O)C(OC1OC=2C=C(C=C(O)C2O)C=3OC4=CC(O)=CC(=O)C4=CC3O)CO)C5=CC(O)=C(O)C(O)=C5
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found in taxon
Nymphaea maculata
1 reference
stated in
Delphinidin 3′-galloylgalactosides from blue flowers of Nymphaéa caerulea
Nymphaea odorata
1 reference
stated in
Delphinidin 3′-galloylgalactosides from blue flowers of Nymphaéa caerulea
Identifiers
InChI
InChI=1S/C28H24O16/c29-8-20-23(38)24(39)26(44-27(40)10-2-14(32)21(36)15(33)3-10)28(43-20)42-19-4-9(1-16(34)22(19)37)25-17(35)7-12-13(31)5-11(30)6-18(12)41-25/h1-7,20,23-24,26,28-30,32-39H,8H2
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InChIKey
QHUWOMZBOYGSPC-UHFFFAOYSA-N
0 references
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