SMILES:
CC(=O)C1CCC2C3CCC4CC(O)C(C)CC4(C)C3C(=O)CC12CMolecular Processing
Molecular formula
C22H34O3
Molecular weight
346.51
Exact mass
346.2508
XLogP
4.02
TPSA
54.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
25
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
96.84
Supplementary Information
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