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(Q105380515)
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English
methyl 2-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}benzoate
group of stereoisomers with the chemical formula C₁₉H₂₆O₁₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
446.14242627199974
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₆O₁₂
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canonical SMILES
O=C(OC)C=1C=CC=CC1OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O
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Identifiers
InChI
InChI=1S/C19H26O12/c1-27-16(25)9-4-2-3-5-10(9)30-17-14(23)13(22)12(21)11(31-17)6-28-18-15(24)19(26,7-20)8-29-18/h2-5,11-15,17-18,20-24,26H,6-8H2,1H3
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InChIKey
ZOIVCDCWDFQVRB-UHFFFAOYSA-N
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PubChem CID
22297417
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZOIVCDCWDFQVRB-UHFFFAOYSA-N
UniChem compound ID
46881869
1 reference
stated in
UniChem
NMRShiftDB structure ID
2781
1 reference
matched by identifier from
InChIKey
InChIKey
ZOIVCDCWDFQVRB-UHFFFAOYSA-N
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