Glycoside
GD033637
Name:
NoneFormula:
C23H20O6N2FClSmiles:
O=C(NCc1ccc(Cl)cc1)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ccc(F)cc2c1=OAglycone:
O=C(NCc1ccc(Cl)cc1)c1c[nH]c2ccc(F)cc2c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 462.86 | Num_heavy_atoms: | 32 |
| TPSA: | 121.02 | NumAromaticRings: | 3 |
Unique Aglycone
AD21454
Formula: C18H12O2N2FCl
Smiles:
O=C(NCc1ccc(Cl)cc1)c1c[nH]c2ccc(F)cc2c1=O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 3.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.75 | Num_heavy_atoms: | 23 |
| TPSA: | 61.96 | NumAromaticRings: | 3 |
