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(Q105186137)
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English
7-hydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-5-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
7-hydroxy-2-(4-hydroxyphenyl)-3-{[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-5-one
1 reference
based on heuristic
inferred from SMILES
mass
432.1056468399999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
7-hydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-5-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₀O₁₀
0 references
canonical SMILES
O=C1C=C(O)C=C2OC(=C(OC3OC(CO)C(O)C(O)C3O)C=C12)C=4C=CC(O)=CC4
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isomeric SMILES
O=c1cc(O)cc2oc(-c3ccc(O)cc3)c(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc1-2
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Identifiers
InChI
InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-24,26-28H,8H2/t16-,17+,18+,19-,21-/m1/s1
0 references
InChIKey
NVBLGZSVOCZYSB-WVXKDWSHSA-N
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