SMILES:
COc1cc(C(=O)O)c(-c2c(C(=O)O)cc(OC)c3c2OCO3)c(OC)c1OCMolecular Processing
Molecular formula
C19H18O10
Molecular weight
406.34
Exact mass
406.09
XLogP
2.51
TPSA
129.98
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
98.13
Supplementary Information
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