Glycoside
GD011957
Name:
NoneFormula:
C12H16O6N2F2Smiles:
CCc1cn(C2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)nc1OC(F)FAglycone:
CCc1c[nH]c(=O)nc1OC(F)FSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.26 | Num_heavy_atoms: | 22 |
| TPSA: | 114.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD09055
Formula: C7H8O2N2F2
Smiles:
CCc1c[nH]c(=O)nc1OC(F)F| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 190.15 | Num_heavy_atoms: | 13 |
| TPSA: | 54.98 | NumAromaticRings: | 1 |
