이름: cholesteryl tosylate
SMILES:
Cc1ccc(S(=O)(=O)O[C@H]2CC[C@@]3(C)C(=CC[C@H]4[C@@H]5CC[C@H]([C@H](C)CCCC(C)C)[C@@]5(C)CC[C@@H]43)C2)cc1Molecular Processing
Molecular formula
C34H52O3S
Molecular weight
540.85
Exact mass
540.3637
XLogP
9.11
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
38
Rings
5
Aromatic rings
1
Saturated rings
3
Aliphatic rings
4
Stereo centers
8
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.765
Molar refractivity
156.28
Supplementary Information
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