SMILES:
CC12CCC(O)CC1CCC1C2CCC2(C)C(C=O)CCC12OMolecular Processing
Molecular formula
C20H32O3
Molecular weight
320.47
Exact mass
320.2351
XLogP
3.32
TPSA
57.53
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
23
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
8
Undefined stereo
8
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.95
Molar refractivity
88.75
Supplementary Information
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