SMILES:
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1cc([N+](=O)[O-])ccc1OCCCCNCC(O)COc1ccccc1Molecular Processing
Molecular formula
C32H41N3O9
Molecular weight
611.69
Exact mass
611.2843
XLogP
4.14
TPSA
158.49
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
17
Heavy atoms
44
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
163.18
Supplementary Information
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