الاسم: ( a )
SMILES:
CC(=O)SCC(CSC(C)=O)C(=O)N1CC(=O)C[C@H]1C(=O)OMolecular Processing
Molecular formula
C13H17NO6S2
Molecular weight
347.41
Exact mass
347.0497
XLogP
0.42
TPSA
108.82
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
22
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
82.53
Supplementary Information
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