SMILES:
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)O[C@H](C(=O)OCI)C(C)CMolecular Processing
Molecular formula
C19H26INO6
Molecular weight
491.32
Exact mass
491.0805
XLogP
3.44
TPSA
90.93
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
27
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
108.09
Supplementary Information
Récupération des détails…
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