SMILES:
COc1ccc(CCC(O)c2cccc(OCC(=O)OC(C)(C)C)c2)cc1OCMolecular Processing
Molecular formula
C23H30O6
Molecular weight
402.49
Exact mass
402.2042
XLogP
4.09
TPSA
74.22
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
29
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.435
Molar refractivity
110.61
Supplementary Information
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