Glycoside
GD049198
Name:
NoneFormula:
C13H15O6N3Smiles:
Cc1cncc(-c2noc(C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)n2)c1Aglycone:
Cc1cncc(-c2ncon2)c1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -1.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 309.28 | Num_heavy_atoms: | 22 |
| TPSA: | 149.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD26088
Formula: C8H7ON3
Smiles:
Cc1cncc(-c2ncon2)c1| 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 |
