CC(C)OC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(=O)O
Name: glutathione monoisopropyl ester
SMILES: CC(C)OC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](N)C(=O)O

Molecular Processing

Molecular formula
C13H23N3O6S
Molecular weight
349.41
Exact mass
349.1308
XLogP
-1.34
TPSA
147.82
H-bond donors
5
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
23
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
84.87

Supplementary Information

Details werden geladen…

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