Glycoside
GD048083
Name:
NoneFormula:
C13H15O6N2ClSmiles:
Cc1cnc(Cl)c(NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c1Aglycone:
Cc1cnc(Cl)c(N)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 318.71 | Num_heavy_atoms: | 21 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25809
Formula: C7H7N2Cl
Smiles:
Cc1cnc(Cl)c(N)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 142.59 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
