CCCCCCCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)C(C)C
SMILES: CCCCCCCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)C(C)C

Molecular Processing

Molecular formula
C32H44N2O6
Molecular weight
552.71
Exact mass
552.3199
XLogP
5.24
TPSA
110.8
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
18
Heavy atoms
40
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
153.79

Supplementary Information

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