CC1CC2(C[C@@H]3CC[C@@H]4[C@H](CC[C@]5(C)C(=O)CC[C@@H]45)[C@@]13C)OCCO2
SMILES: CC1CC2(C[C@@H]3CC[C@@H]4[C@H](CC[C@]5(C)C(=O)CC[C@@H]45)[C@@]13C)OCCO2

Molecular Processing

Molecular formula
C22H34O3
Molecular weight
346.51
Exact mass
346.2508
XLogP
4.59
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
25
Rings
5
Aromatic rings
0
Saturated rings
5
Aliphatic rings
5
Stereo centers
7
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.955
Molar refractivity
95.92

Supplementary Information

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