COc1ccc(C[C@H](NC(=O)[C@H](COCc2ccccc2)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1
SMILES: COc1ccc(C[C@H](NC(=O)[C@H](COCc2ccccc2)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1

Molecular Processing

Molecular formula
C37H45N3O8
Molecular weight
659.78
Exact mass
659.3207
XLogP
3.92
TPSA
144.59
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
16
Heavy atoms
48
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.405
Molar refractivity
179.33

Supplementary Information

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