Glycoside
GD049222
Name:
NoneFormula:
C13H15O6N3Smiles:
Cc1ncccc1-c1noc([C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@H]2O)n1Aglycone:
Cc1ncccc1-c1ncon1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 2 |
| MolWt: | 309.28 | Num_heavy_atoms: | 22 |
| TPSA: | 141.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD26090
Formula: C8H7ON3
Smiles:
Cc1ncccc1-c1ncon1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 161.16 | Num_heavy_atoms: | 12 |
| TPSA: | 51.81 | NumAromaticRings: | 2 |
