C[C@]12CCC(=O)C(Cl)=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)C[C@@H]3C[C@]312
Name: 4-Chloro-17β-hydroxy-14α,15α-methylene-androst-4-ene-3-one
SMILES: C[C@]12CCC(=O)C(Cl)=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)C[C@@H]3C[C@]312

Molecular Processing

Molecular formula
C20H27ClO2
Molecular weight
334.89
Exact mass
334.17
XLogP
4.45
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
23
Rings
5
Aromatic rings
0
Saturated rings
4
Aliphatic rings
5
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.85
Molar refractivity
89.95

Supplementary Information

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Involved in 4 reactions→

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