CC12CC3(C)CC(c4ccc(O)cc4)(C1)CC(C14CC5(C)CC(C)(CC(c6ccc(O)cc6)(C5)C1)C4)(C2)C3
SMILES: CC12CC3(C)CC(c4ccc(O)cc4)(C1)CC(C14CC5(C)CC(C)(CC(c6ccc(O)cc6)(C5)C1)C4)(C2)C3

Molecular Processing

Molecular formula
C36H46O2
Molecular weight
510.76
Exact mass
510.3498
XLogP
9.03
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
38
Rings
10
Aromatic rings
2
Saturated rings
8
Aliphatic rings
8
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
152.27

Supplementary Information

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