Glycoside
GD017714
Name:
NoneFormula:
C15H19O4N3Smiles:
Cc1nnn(C[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1-c1ccccc1Aglycone:
Cc1nnn(C)c1-c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 305.33 | Num_heavy_atoms: | 22 |
| TPSA: | 100.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD12617
Formula: C10H11N3
Smiles:
Cc1nnn(C)c1-c1ccccc1| 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 |
