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(Q108530238)
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English
chrozophoridin
chemical compound
6'-hydroxy-4,4'-dimethoxy-1,1'-dimethyl-5'-{[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-[3,3'-bipyridine]-2,2',5,6(1H,1'H)-tetraone
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instance of
type of chemical entity
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subclass of
chemical compound
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chemical structure
Chrozophoridin.svg
765 × 490; 24 KB
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mass
500.12783882799965
dalton
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based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₄N₂O₁₃
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canonical SMILES
COC1C(=O)C(=O)N(C)C(=O)C=1C(=C2OC)C(=O)N(C)C(O)=C2OC3C(O)C(O)C(O)C(O3)CO
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described by source
A 1000-year-old mystery solved: Unlocking the molecular structure for the medieval blue from Chrozophora tinctoria, also known as folium
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Identifiers
InChI
InChI=1S/C20H24N2O13/c1-21-16(28)7(13(32-3)12(27)18(21)30)8-14(33-4)15(19(31)22(2)17(8)29)35-20-11(26)10(25)9(24)6(5-23)34-20/h6,9-11,20,23-26,31H,5H2,1-4H3
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InChIKey
PWRIEQVXHAGZLC-UHFFFAOYSA-N
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DSSTox substance ID
DTXSID001337058
1 reference
matched by identifier from
InChIKey
InChIKey
PWRIEQVXHAGZLC-UHFFFAOYSA-N
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