Nom: 16α-bromo-3β,7β,17β-trihydroxyandrost-5-ene
SMILES:
C[C@]12CC[C@H]3[C@@H]([C@@H](O)C=C4C[C@@H](O)CC[C@@]43C)[C@@H]1C[C@@H](Br)[C@@H]2OMolecular Processing
Molecular formula
C19H29BrO3
Molecular weight
385.34
Exact mass
384.13
XLogP
3.02
TPSA
60.69
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
23
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
9
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.895
Molar refractivity
93.2
Supplementary Information
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