이름: 3α-acetoxy-5α-androstan-17-one
SMILES:
CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1Molecular Processing
Molecular formula
C21H32O3
Molecular weight
332.48
Exact mass
332.2351
XLogP
4.53
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
24
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.905
Molar refractivity
92.29
Supplementary Information
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