CC(C)CCCC(C)C1CCC2C3CCC4CC(N5CC(OS(C)(=O)=O)C5)CCC4(C)C3CCC12C
SMILES: CC(C)CCCC(C)C1CCC2C3CCC4CC(N5CC(OS(C)(=O)=O)C5)CCC4(C)C3CCC12C

Molecular Processing

Molecular formula
C31H55NO3S
Molecular weight
521.85
Exact mass
521.3903
XLogP
7.14
TPSA
46.61
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
36
Rings
5
Aromatic rings
0
Saturated rings
5
Aliphatic rings
5
Stereo centers
9
Undefined stereo
9
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
1
Molar refractivity
148.15

Supplementary Information

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