COc1ccc(C(C)(C)NC(=O)C2CCC3C4CC=C5C=C(C(=O)[O-])CCC5(C)C4CCC23C)cc1
SMILES: COc1ccc(C(C)(C)NC(=O)C2CCC3C4CC=C5C=C(C(=O)[O-])CCC5(C)C4CCC23C)cc1

Molecular Processing

Molecular formula
C31H40NO4-
Molecular weight
490.66
Exact mass
490.2963
XLogP
4.91
TPSA
78.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
36
Rings
5
Aromatic rings
1
Saturated rings
2
Aliphatic rings
4
Stereo centers
6
Undefined stereo
6
Formal charge
-1
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.613
Molar refractivity
137.83

Supplementary Information

Obteniendo detalles…

Participa en 1 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→