Glycoside
GD073031
Name:
NoneFormula:
C17H16O7N3ClSmiles:
O=C(Nc1cc(Cl)nn(-c2ccccc2)c1=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1cc(Cl)nn(-c2ccccc2)c1=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 397.77 | Num_heavy_atoms: | 27 |
| TPSA: | 161.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD33941
Formula: C11H8ON3Cl
Smiles:
Nc1cc(Cl)nn(-c2ccccc2)c1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 221.65 | Num_heavy_atoms: | 15 |
| TPSA: | 60.91 | NumAromaticRings: | 2 |
