SMILES:
CCCCCCCCCCCCCCCCOCC(COC(c1ccccc1)(c1ccccc1)c1ccccc1)COS(C)(=O)=OMolecular Processing
Molecular formula
C40H58O5S
Molecular weight
650.97
Exact mass
650.4005
XLogP
10.09
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
26
Heavy atoms
46
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.55
Molar refractivity
190.58
Supplementary Information
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