SMILES:
CC1CC2=CC(=O)CCC2(CO)C2CCC3(C)C(O)CCC3C12Molecular Processing
Molecular formula
C20H30O3
Molecular weight
318.46
Exact mass
318.2195
XLogP
3.1
TPSA
57.53
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
23
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
7
Undefined stereo
7
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.85
Molar refractivity
88.68
Supplementary Information
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