COC(=O)C1(OC(=O)c2ccc(O)o2)C(C)CC2C3CC(F)C4=CC(=O)C=CC4(C)C34OC4CC21C
SMILES: COC(=O)C1(OC(=O)c2ccc(O)o2)C(C)CC2C3CC(F)C4=CC(=O)C=CC4(C)C34OC4CC21C

Molecular Processing

Molecular formula
C27H29FO8
Molecular weight
500.52
Exact mass
500.1846
XLogP
3.69
TPSA
115.57
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
36
Rings
6
Aromatic rings
1
Saturated rings
4
Aliphatic rings
5
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.593
Molar refractivity
121.47

Supplementary Information

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