Glycoside
GD049967
Name:
NoneFormula:
C13H18O7N2Smiles:
COC(=O)c1cccnc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COC(=O)c1cccnc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.29 | Num_heavy_atoms: | 22 |
| TPSA: | 141.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD26428
Formula: C7H8O2N2
Smiles:
COC(=O)c1cccnc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
