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(Q105138489)
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English
3-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-4-methoxy-4-oxobutanoic acid
group of stereoisomers with the chemical formula C₂₀H₂₀O₁₀
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Statements
instance of
group of stereoisomers
0 references
subclass of
flavan
1 reference
inferred from
flavan
mass
420.3676
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₀O₁₀
0 references
canonical SMILES
O=C(O)CC(OC1CC=2C(O)=CC(O)=CC2OC1C3=CC=C(O)C(O)=C3)C(=O)OC
0 references
Identifiers
InChI
InChI=1S/C20H20O10/c1-28-20(27)17(8-18(25)26)29-16-7-11-13(23)5-10(21)6-15(11)30-19(16)9-2-3-12(22)14(24)4-9/h2-6,16-17,19,21-24H,7-8H2,1H3,(H,25,26)
0 references
InChIKey
KBRCLNZPIXOEQJ-UHFFFAOYSA-N
0 references
PubChem CID
74323772
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KBRCLNZPIXOEQJ-UHFFFAOYSA-N
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