Name: product
SMILES:
COc1ccc(CS[C@H]2CO[C@@H](COS(=O)(=O)c3ccc(C)cc3)[C@@H]2O)cc1Molecular Processing
Molecular formula
C20H24O6S2
Molecular weight
424.54
Exact mass
424.1014
XLogP
2.77
TPSA
82.06
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
108.14
Supplementary Information
Details werden geladen…
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