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(Q104919619)
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English
[4,5-Dihydroxy-2-[5-hydroxy-2-(4-methoxy-6-oxopyran-2-yl)-3-methylphenoxy]-6-(hydroxymethyl)oxan-3-yl] 3-(4-hydroxyphenyl)prop-2-enoate
group of stereoisomers with the chemical formula C₂₈H₂₈O₁₂
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
556.1580763359997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₈H₂₈O₁₂
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canonical SMILES
O=C(OC1C(OC2=CC(O)=CC(=C2C=3OC(=O)C=C(OC)C3)C)OC(CO)C(O)C1O)C=CC4=CC=C(O)C=C4
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Identifiers
InChI
InChI=1S/C28H28O12/c1-14-9-17(31)10-19(24(14)20-11-18(36-2)12-23(33)37-20)38-28-27(26(35)25(34)21(13-29)39-28)40-22(32)8-5-15-3-6-16(30)7-4-15/h3-12,21,25-31,34-35H,13H2,1-2H3
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InChIKey
AVKZBTISTJWNNL-UHFFFAOYSA-N
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PubChem CID
163077234
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AVKZBTISTJWNNL-UHFFFAOYSA-N
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