Glycoside
GD049074
Name:
NoneFormula:
C12H14O6N3ClSmiles:
Cc1nc(Cl)cc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)n1Aglycone:
Cc1nc(N)cc(Cl)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 319.7 | Num_heavy_atoms: | 21 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD26038
Formula: C6H6N3Cl
Smiles:
Cc1nc(N)cc(Cl)n1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 143.58 | Num_heavy_atoms: | 9 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
