SMILES:
O=C(OCc1ccccc1)C1OC(O)C(O)C(O)C1OMolecular Processing
Molecular formula
C13H16O7
Molecular weight
284.26
Exact mass
284.0896
XLogP
-1.47
TPSA
116.45
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
65.14
Supplementary Information
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