Glycoside
GD146945
Name:
NoneFormula:
C11H16O6N2Smiles:
[O-][NH+](O)c1cccc(NC2OC(CO)C(O)C2O)c1Aglycone:
Nc1cccc([NH+]([O-])O)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.45 |
| AlogP: | -2.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 272.26 | Num_heavy_atoms: | 19 |
| TPSA: | 129.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD58877
Formula: C6H8O2N2
Smiles:
Nc1cccc([NH+]([O-])O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 140.14 | Num_heavy_atoms: | 10 |
| TPSA: | 73.75 | NumAromaticRings: | 1 |
