SMILES:
CN(C)[C@@H](CC(=O)O)C(=O)O.O=S(=O)(O)OMolecular Processing
Molecular formula
C6H13NO8S
Molecular weight
259.24
Exact mass
259.0362
XLogP
-1.18
TPSA
152.44
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.667
Molar refractivity
51.54
Supplementary Information
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