SMILES:
COc1cc(OC)nc(Oc2cccc3c2C(=O)OC3OC(C)=O)n1Molecular Processing
Molecular formula
C16H14N2O7
Molecular weight
346.3
Exact mass
346.0801
XLogP
2.02
TPSA
106.07
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
81.57
Supplementary Information
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