COc1ccc(CN2C(=O)[C@@H](NC(=O)OCc3ccccc3)[C@H]2[C@@H]2COC(=O)O2)cc1OC
SMILES: COc1ccc(CN2C(=O)[C@@H](NC(=O)OCc3ccccc3)[C@H]2[C@@H]2COC(=O)O2)cc1OC

Molecular Processing

Molecular formula
C23H24N2O8
Molecular weight
456.45
Exact mass
456.1533
XLogP
2.25
TPSA
112.63
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
113.66

Supplementary Information

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