CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C
Nombre: turkesterone
SMILES: CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3[C@H](O)C[C@]12C

Molecular Processing

Molecular formula
C27H44O8
Molecular weight
496.64
Exact mass
496.3036
XLogP
0.82
TPSA
158.68
H-bond donors
7
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
35
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
11
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.889
Molar refractivity
127.99

Supplementary Information

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