이름: 19-hydroxyandrost-4-ene-3,17-dione
SMILES:
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43CO)[C@@H]1CCC2=OMolecular Processing
Molecular formula
C19H26O3
Molecular weight
302.41
Exact mass
302.1882
XLogP
3.06
TPSA
54.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.789
Molar refractivity
83.13
Supplementary Information
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