Glycoside
GD022092
Name:
NoneFormula:
C11H13O5N3Smiles:
O=C1CC=Nc2c1cnn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=C1CC=NC2=C1C=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 2 |
| MolWt: | 267.24 | Num_heavy_atoms: | 19 |
| TPSA: | 117.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD15019
Formula: C6H4ON3
Smiles:
O=C1CC=NC2=C1C=N[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 55.89 | NumAromaticRings: | 0 |
