C=CCN(C(=O)OCc1ccccc1)c1cnc2n(c1=O)[C@@H](C(=O)NCc1ccc(C(=N)NC(=O)OCc3ccccc3)cc1)C[C@@]2(C)CC(=O)O
Nombre: intermediate 39a
SMILES: C=CCN(C(=O)OCc1ccccc1)c1cnc2n(c1=O)[C@@H](C(=O)NCc1ccc(C(=N)NC(=O)OCc3ccccc3)cc1)C[C@@]2(C)CC(=O)O

Molecular Processing

Molecular formula
C38H38N6O8
Molecular weight
706.76
Exact mass
706.2751
XLogP
4.82
TPSA
193.01
H-bond donors
4
H-bond acceptors
9
Rotatable bonds
13
Heavy atoms
52
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.237
Molar refractivity
190.81

Supplementary Information

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