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(Q105145566)
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English
5-({6-[(6-acetyl-2-methylchromen-2-yl)methoxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-hydroxy-3-methyl-5-oxopentanoic acid
group of stereoisomers with the chemical formula C₂₅H₃₂O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
3-chromene
1 reference
inferred from
3-chromene
mass
524.1893764639997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₂O₁₂
0 references
canonical SMILES
O=C(O)CC(O)(C)CC(=O)OCC1OC(OCC2(OC=3C=CC(=CC3C=C2)C(=O)C)C)C(O)C(O)C1O
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Identifiers
InChI
InChI=1S/C25H32O12/c1-13(26)14-4-5-16-15(8-14)6-7-25(3,37-16)12-35-23-22(32)21(31)20(30)17(36-23)11-34-19(29)10-24(2,33)9-18(27)28/h4-8,17,20-23,30-33H,9-12H2,1-3H3,(H,27,28)
0 references
InChIKey
KSRUZCVAFJSUFJ-UHFFFAOYSA-N
0 references
PubChem CID
14162653
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KSRUZCVAFJSUFJ-UHFFFAOYSA-N
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