Glycoside
GD054213
Name:
NoneFormula:
C13H17O6N5Smiles:
Cc1nccn2c(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nnc12Aglycone:
Cc1nccn2c(C(N)=O)nnc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -3.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 339.31 | Num_heavy_atoms: | 24 |
| TPSA: | 162.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD27633
Formula: C7H7ON5
Smiles:
Cc1nccn2c(C(N)=O)nnc12| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 177.17 | Num_heavy_atoms: | 13 |
| TPSA: | 86.17 | NumAromaticRings: | 2 |
