CCCCCCCCCCCCCCCC(=O)OCC(C[N+](C)(C)CCCCCCCCCCCCCCCCCCCCO)OC(=O)CCCCCCCCCCCCCCC
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(C[N+](C)(C)CCCCCCCCCCCCCCCCCCCCO)OC(=O)CCCCCCCCCCCCCCC

Molecular Processing

Molecular formula
C57H114NO5+
Molecular weight
893.54
Exact mass
892.8692
XLogP
17.49
TPSA
72.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
53
Heavy atoms
63
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
1
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.965
Molar refractivity
273.5

Supplementary Information

Récupération des détails…

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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→