Glycoside
GD049422
Name:
NoneFormula:
C12H17O7N3Smiles:
C=CC(=O)OCc1cn(C[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O)nn1Aglycone:
C=CC(=O)OCc1cn(C)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -2.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 147.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD26172
Formula: C7H9O2N3
Smiles:
C=CC(=O)OCc1cn(C)nn1| HBA: | 5 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 167.17 | Num_heavy_atoms: | 12 |
| TPSA: | 57.01 | NumAromaticRings: | 1 |
