C[C@]12CC(=O)[C@@H]3c4ccc(OCc5ccccc5)cc4CC[C@H]3[C@@H]1CC[C@@H]2OCc1ccccc1
SMILES: C[C@]12CC(=O)[C@@H]3c4ccc(OCc5ccccc5)cc4CC[C@H]3[C@@H]1CC[C@@H]2OCc1ccccc1

Molecular Processing

Molecular formula
C32H34O3
Molecular weight
466.62
Exact mass
466.2508
XLogP
6.89
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
35
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.406
Molar refractivity
137.24

Supplementary Information

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