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(Q105122624)
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English
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-[2-(5-oxo-2H-furan-3-yl)ethyl]-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylate
group of stereoisomers with the chemical formula C₂₃H₃₂O₉
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
452.20463260399976
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₃₂O₉
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canonical SMILES
O=C1OCC(=C1)CCC2CCCC3C(=CCCC32)C(=O)OC4OC(CO)C(O)C(O)C4O
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Identifiers
InChI
InChI=1S/C23H32O9/c24-10-17-19(26)20(27)21(28)23(31-17)32-22(29)16-6-2-4-14-13(3-1-5-15(14)16)8-7-12-9-18(25)30-11-12/h6,9,13-15,17,19-21,23-24,26-28H,1-5,7-8,10-11H2
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InChIKey
IYBBMUKGQPWHAT-UHFFFAOYSA-N
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PubChem CID
162996826
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IYBBMUKGQPWHAT-UHFFFAOYSA-N
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