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(Q104200437)
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English
1,7-dihydroxy-3-methoxy-6-methyl-2-(4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl)anthracene-9,10-dione
group of stereoisomers with the chemical formula C₃₂H₂₆O₁₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic anthraquinones
1 reference
inferred from
biogenic anthraquinones
mass
618.137340892
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₂H₂₆O₁₃
0 references
canonical SMILES
O=C1C2=CC(=C(O)C=C2C(=O)C3=C(O)C(=C(OC)C=C13)C4=C(OC)C=C(O)C=5C(=O)C6=C(C(=O)C54)C(O)C(O)(C)C(O)C6O)C
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Identifiers
InChI
InChI=1S/C32H26O13/c1-9-5-10-11(6-13(9)33)25(36)17-12(24(10)35)7-15(44-3)20(26(17)37)19-16(45-4)8-14(34)18-21(19)28(39)23-22(27(18)38)29(40)31(42)32(2,43)30(23)41/h5-8,29-31,33-34,37,40-43H,1-4H3
0 references
InChIKey
WNKYPOGUIDZODB-UHFFFAOYSA-N
0 references
PubChem CID
56670785
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WNKYPOGUIDZODB-UHFFFAOYSA-N
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