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(Q105115625)
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English
2-[[7-[(3,4-Dihydroxyoxan-2-yl)oxymethyl]-5-hydroxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-10-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
group of stereoisomers with the chemical formula C₂₀H₃₀O₁₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
iridoid
1 reference
inferred from
iridoid
mass
478.1686410199997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₀O₁₃
0 references
canonical SMILES
OCC1OC(OC2OC=C(COC3OCCC(O)C3O)C4C(O)C5OC5C24)C(O)C(O)C1O
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Identifiers
InChI
InChI=1S/C20H30O13/c21-3-8-12(24)14(26)15(27)20(31-8)33-18-10-9(13(25)17-16(10)32-17)6(4-29-18)5-30-19-11(23)7(22)1-2-28-19/h4,7-27H,1-3,5H2
0 references
InChIKey
IMEGVKSWPUMUQL-UHFFFAOYSA-N
0 references
PubChem CID
162951621
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IMEGVKSWPUMUQL-UHFFFAOYSA-N
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