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(Q105224839)
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English
[6-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-4,5-dihydroxyoxan-3-yl] benzoate
group of stereoisomers with the chemical formula C₂₇H₂₄O₈
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Statements
instance of
group of stereoisomers
0 references
subclass of
anthrone polyketide
1 reference
inferred from
anthrone polyketide
mass
476.147117728
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₂₄O₈
0 references
canonical SMILES
O=C(OC1COC(C(O)C1O)C2C=3C=CC=C(O)C3C(=O)C4=C(O)C=C(C=C42)C)C=5C=CC=CC5
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Identifiers
InChI
InChI=1S/C27H24O8/c1-13-10-16-20(15-8-5-9-17(28)21(15)24(31)22(16)18(29)11-13)26-25(32)23(30)19(12-34-26)35-27(33)14-6-3-2-4-7-14/h2-11,19-20,23,25-26,28-30,32H,12H2,1H3
0 references
InChIKey
QOELVAZTKSBQPZ-UHFFFAOYSA-N
0 references
PubChem CID
72753511
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QOELVAZTKSBQPZ-UHFFFAOYSA-N
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