C#CCC1CC2C(CCC3(C)C(=O)CCC23)C2(C)C=CC(=O)C=C12
SMILES: C#CCC1CC2C(CCC3(C)C(=O)CCC23)C2(C)C=CC(=O)C=C12

Molecular Processing

Molecular formula
C22H26O2
Molecular weight
322.45
Exact mass
322.1933
XLogP
4.11
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
24
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
93.95

Supplementary Information

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