SMILES:
COC(=O)CC(=O)c1cc2c(cc1OCc1ccccc1)OCO2Molecular Processing
Molecular formula
C18H16O6
Molecular weight
328.32
Exact mass
328.0947
XLogP
2.74
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
84.3
Supplementary Information
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