CC(=O)OC1C(COCc2ccccc2)OC(OC(=N)C(Cl)(Cl)Cl)C(OC(C)=O)C1OC(C)=O
SMILES: CC(=O)OC1C(COCc2ccccc2)OC(OC(=N)C(Cl)(Cl)Cl)C(OC(C)=O)C1OC(C)=O

Molecular Processing

Molecular formula
C21H24Cl3NO9
Molecular weight
540.78
Exact mass
539.0517
XLogP
3.09
TPSA
130.44
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
34
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
120.52

Supplementary Information

Récupération des détails…

Impliqué dans 1 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→