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(Q104976010)
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English
[2-[1,7-Bis(3,4-dihydroxyphenyl)-5-oxoheptan-3-yl]oxy-4,5-dihydroxyoxan-3-yl] 2-methylbutanoate
group of stereoisomers with the chemical formula C₂₉H₃₈O₁₁
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic alkylphenol
1 reference
inferred from
biogenic alkylphenol
mass
562.2414120359998
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₃₈O₁₁
0 references
canonical SMILES
O=C(OC1C(OCC(O)C1O)OC(CC(=O)CCC2=CC=C(O)C(O)=C2)CCC3=CC=C(O)C(O)=C3)C(C)CC
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Identifiers
InChI
InChI=1S/C29H38O11/c1-3-16(2)28(37)40-27-26(36)25(35)15-38-29(27)39-20(9-5-18-7-11-22(32)24(34)13-18)14-19(30)8-4-17-6-10-21(31)23(33)12-17/h6-7,10-13,16,20,25-27,29,31-36H,3-5,8-9,14-15H2,1-2H3
0 references
InChIKey
DCXFPVCKNREVLL-UHFFFAOYSA-N
0 references
PubChem CID
73014732
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DCXFPVCKNREVLL-UHFFFAOYSA-N
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