SMILES:
CC(=O)Oc1cc(C)c(CC(NC(=O)OC(C)(C)C)C(=O)O)c(C)c1Molecular Processing
Molecular formula
C18H25NO6
Molecular weight
351.4
Exact mass
351.1682
XLogP
2.75
TPSA
101.93
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
25
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
91.72
Supplementary Information
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