CCOCC(=O)OCOc1c(OC)ccnc1C(=O)N[C@H]1CCC[C@H](Cc2ccc(C)cc2)[C@@H](OCCCC(F)(F)F)[C@H](C)OC1=O
SMILES: CCOCC(=O)OCOc1c(OC)ccnc1C(=O)N[C@H]1CCC[C@H](Cc2ccc(C)cc2)[C@@H](OCCCC(F)(F)F)[C@H](C)OC1=O

Molecular Processing

Molecular formula
C33H43F3N2O9
Molecular weight
668.71
Exact mass
668.2921
XLogP
5.12
TPSA
131.51
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
15
Heavy atoms
47
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.576
Molar refractivity
162.93

Supplementary Information

Récupération des détails…

Impliqué dans 1 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→