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(Q105182158)
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English
1,3-Dihydroxy-4,5-bis[(4-hydroxy-3-methoxybenzoyl)oxy]cyclohexane-1-carboxylic acid
group of stereoisomers
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Statements
instance of
group of stereoisomers
0 references
subclass of
burkinabin
0 references
mass
492.1267762079997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₂₄O₁₂
0 references
canonical SMILES
O=C(O)C1(O)CC(O)C(OC(=O)C2=CC=C(O)C(OC)=C2)C(OC(=O)C3=CC=C(O)C(OC)=C3)C1
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Identifiers
InChI
InChI=1S/C23H24O12/c1-32-16-7-11(3-5-13(16)24)20(27)34-18-10-23(31,22(29)30)9-15(26)19(18)35-21(28)12-4-6-14(25)17(8-12)33-2/h3-8,15,18-19,24-26,31H,9-10H2,1-2H3,(H,29,30)
0 references
InChIKey
NNIPMYIDMKBMBF-UHFFFAOYSA-N
0 references
PubChem CID
57473120
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NNIPMYIDMKBMBF-UHFFFAOYSA-N
UniChem compound ID
55045905
1 reference
stated in
UniChem
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