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(Q104936000)
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English
1-[2,4-Dihydroxy-3,5-dimethyl-6-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxyphenyl]-2-methylbutan-1-one
group of stereoisomers with the chemical formula C₂₅H₃₈O₁₃
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
546.2312412759997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₈O₁₃
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canonical SMILES
O=C(C=1C(O)=C(C(O)=C(C1OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)C)C)C(C)CC
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Identifiers
InChI
InChI=1S/C25H38O13/c1-6-8(2)14(26)13-16(28)9(3)15(27)10(4)23(13)38-25-22(34)20(32)18(30)12(37-25)7-35-24-21(33)19(31)17(29)11(5)36-24/h8,11-12,17-22,24-25,27-34H,6-7H2,1-5H3
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InChIKey
BHJACXRCFCZATN-UHFFFAOYSA-N
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PubChem CID
163037129
1 reference
based on heuristic
inferred from InChIKey
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