CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](NC(=O)C(C)(C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)C
Name: #68
SMILES: CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)OC)N(C)C(=O)[C@@H](NC(=O)C(C)(C)NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)C

Molecular Processing

Molecular formula
C53H73N5O10
Molecular weight
940.19
Exact mass
939.5357
XLogP
6.27
TPSA
181.91
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
22
Heavy atoms
68
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
8
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.547
Molar refractivity
259.27

Supplementary Information

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