CCOC(=O)C(NCCCNC(=O)[C@@H](N)CC(C)C)[C@@H](OC(C)=O)[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O
SMILES: CCOC(=O)C(NCCCNC(=O)[C@@H](N)CC(C)C)[C@@H](OC(C)=O)[C@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Molecular Processing

Molecular formula
C28H43N5O12
Molecular weight
641.68
Exact mass
641.2908
XLogP
-1.37
TPSA
236.44
H-bond donors
4
H-bond acceptors
14
Rotatable bonds
16
Heavy atoms
45
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
7
Undefined stereo
1
Formal charge
0
Heteroatoms
17
Covalent units
1
Fraction Csp3
0.679
Molar refractivity
155.38

Supplementary Information

Obteniendo detalles…

Participa en 1 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→