Glycoside
GD030172
Name:
NoneFormula:
C11H11O5N4F3Smiles:
O=c1[nH]cnc2c1nc(C(F)(F)F)n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1N=C(C(F)(F)F)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 336.23 | Num_heavy_atoms: | 23 |
| TPSA: | 133.49 | NumAromaticRings: | 2 |
Unique Aglycone
AD19540
Formula: C6H2ON4F3
Smiles:
O=c1[nH]cnc2c1N=C(C(F)(F)F)[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 203.1 | Num_heavy_atoms: | 14 |
| TPSA: | 72.21 | NumAromaticRings: | 1 |
