Glycoside
GD025540
Name:
NoneFormula:
C17H18O6N3F3Smiles:
Cc1nc(N[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)[nH]c1-c1ccc(C(F)(F)F)cc1Aglycone:
Cc1nc(N)[nH]c1-c1ccc(C(F)(F)F)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 417.34 | Num_heavy_atoms: | 29 |
| TPSA: | 147.93 | NumAromaticRings: | 2 |
Unique Aglycone
AD16922
Formula: C11H10N3F3
Smiles:
Cc1nc(N)[nH]c1-c1ccc(C(F)(F)F)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 241.22 | Num_heavy_atoms: | 17 |
| TPSA: | 54.7 | NumAromaticRings: | 2 |
