Glycoside
GD088238
Name:
NoneFormula:
C18H20O8N3FSmiles:
CCOC(=O)c1cnn(-c2ccccc2F)c1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CCOC(=O)c1cnn(-c2ccccc2F)c1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 9 |
| MolWt: | 425.37 | Num_heavy_atoms: | 30 |
| TPSA: | 171.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD38622
Formula: C12H12O2N3F
Smiles:
CCOC(=O)c1cnn(-c2ccccc2F)c1N| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 249.25 | Num_heavy_atoms: | 18 |
| TPSA: | 70.14 | NumAromaticRings: | 2 |
