SMILES:
CC12OCCN1C(=O)c1cc3c(cc1O2)OCO3Molecular Processing
Molecular formula
C12H11NO5
Molecular weight
249.22
Exact mass
249.0637
XLogP
0.95
TPSA
57.23
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
18
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
58.59
Supplementary Information
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