Glycoside
GD049287
Name:
NoneFormula:
C12H19O7N3Smiles:
CCC(=O)OCc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)nn1Aglycone:
CCC(=O)OCC1=C[N]N=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -2.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 317.3 | Num_heavy_atoms: | 22 |
| TPSA: | 147.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD26125
Formula: C6H8O2N3
Smiles:
CCC(=O)OCC1=C[N]N=N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 154.15 | Num_heavy_atoms: | 11 |
| TPSA: | 65.12 | NumAromaticRings: | 0 |
