SMILES:
COc1ccc2c(c1OC)OC(C(=O)O)Oc1ccccc1C21CC1Molecular Processing
Molecular formula
C19H18O6
Molecular weight
342.35
Exact mass
342.1103
XLogP
2.97
TPSA
74.22
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
88.68
Supplementary Information
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