Glycoside
GD068014
Name:
NoneFormula:
C16H21O6N3Smiles:
Cn1cncc1Nc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cn1cncc1Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 129.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD32260
Formula: C10H11ON3
Smiles:
Cn1cncc1Nc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 2 |
| MolWt: | 189.22 | Num_heavy_atoms: | 14 |
| TPSA: | 50.08 | NumAromaticRings: | 2 |
