COC(C)CCO[C@@H]1[C@@H](Cc2ccccc2)COC[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H]1C
SMILES: COC(C)CCO[C@@H]1[C@@H](Cc2ccccc2)COC[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@H]1C

Molecular Processing

Molecular formula
C25H39NO7
Molecular weight
465.59
Exact mass
465.2727
XLogP
3.51
TPSA
92.32
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
33
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.68
Molar refractivity
123.99

Supplementary Information

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