Glycoside
GD049281
Name:
NoneFormula:
C11H17O7N3Smiles:
CC(=O)OCc1cn(C[C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@H]2O)nn1Aglycone:
CC(=O)OCc1cn(C)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -2.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 303.27 | Num_heavy_atoms: | 21 |
| TPSA: | 147.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD26120
Formula: C6H9O2N3
Smiles:
CC(=O)OCc1cn(C)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 155.16 | Num_heavy_atoms: | 11 |
| TPSA: | 57.01 | NumAromaticRings: | 1 |
