CCOC(C)OC(C)(C)C(F)CCC(COS(=O)(=O)c1ccc(C)cc1)C1CCC2C3CC=C4CC(OC5CCCCO5)CC(OC5CCCCO5)C4(C)C3CCC12C
SMILES: CCOC(C)OC(C)(C)C(F)CCC(COS(=O)(=O)c1ccc(C)cc1)C1CCC2C3CC=C4CC(OC5CCCCO5)CC(OC5CCCCO5)C4(C)C3CCC12C

Molecular Processing

Molecular formula
C48H75FO9S
Molecular weight
847.18
Exact mass
846.5116
XLogP
10.63
TPSA
98.75
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
17
Heavy atoms
59
Rings
7
Aromatic rings
1
Saturated rings
5
Aliphatic rings
6
Stereo centers
13
Undefined stereo
13
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
225.69

Supplementary Information

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