이름: 4-androstene-3β,17β,19-triol 17,19-diacetate
SMILES:
CC(=O)OC[C@]12CC[C@H](O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](OC(C)=O)CC[C@@H]12Molecular Processing
Molecular formula
C23H34O5
Molecular weight
390.52
Exact mass
390.2406
XLogP
3.79
TPSA
72.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.826
Molar refractivity
104.22
Supplementary Information
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