Glycoside
GD083556
Name:
NoneFormula:
C20H20O6N3FSmiles:
O=C(Nc1ccc2c(cnn2Cc2cccc(F)c2)c1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Nc1ccc2c(cnn2Cc2cccc(F)c2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 8 |
| MolWt: | 417.39 | Num_heavy_atoms: | 30 |
| TPSA: | 144.91 | NumAromaticRings: | 3 |
Unique Aglycone
AD37279
Formula: C14H12N3F
Smiles:
Nc1ccc2c(cnn2Cc2cccc(F)c2)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 241.27 | Num_heavy_atoms: | 18 |
| TPSA: | 43.84 | NumAromaticRings: | 3 |
