Glycoside
GD051832
Name:
NoneFormula:
C15H19O5N3Smiles:
Cc1ccccc1-c1cn(C[C@H]2O[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O)nn1Aglycone:
Cc1ccccc1-c1cn(C)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.33 | Num_heavy_atoms: | 23 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD27023
Formula: C10H11N3
Smiles:
Cc1ccccc1-c1cn(C)nn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 1 |
| MolWt: | 173.22 | Num_heavy_atoms: | 13 |
| TPSA: | 30.71 | NumAromaticRings: | 2 |
