Nom: (+)-(4aR)-(10bR)-4-methyl-8-mercapto-10b-methyl-1,2,3,4,4a,-5,6,10b-octahydrobenzo[f]quinolin-3-one
SMILES:
CN1C(=O)CC[C@]2(C)c3ccc(S)cc3CC[C@@H]12Molecular Processing
Molecular formula
C15H19NOS
Molecular weight
261.39
Exact mass
261.1187
XLogP
2.8
TPSA
20.31
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
75.16
Supplementary Information
Récupération des détails…
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