Название: 17β-methanesulfonyloxy-1,4-androstadiene-3,11-dione
SMILES:
C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@@H]2OS(C)(=O)=OMolecular Processing
Molecular formula
C20H26O5S
Molecular weight
378.49
Exact mass
378.1501
XLogP
2.82
TPSA
77.51
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
26
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
96.72
Supplementary Information
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