Glycoside
GD064885
Name:
NoneFormula:
C14H20O7N2F2Smiles:
O=C(N[C@]12C[C@](C(=O)NCC(F)F)(C1)C2)[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1OAglycone:
O=CNC12CC(C(=O)NCC(F)F)(C1)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | -2.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 366.32 | Num_heavy_atoms: | 25 |
| TPSA: | 148.35 | NumAromaticRings: | 0 |
Unique Aglycone
AD31226
Formula: C9H12O2N2F2
Smiles:
O=CNC12CC(C(=O)NCC(F)F)(C1)C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 218.2 | Num_heavy_atoms: | 15 |
| TPSA: | 58.2 | NumAromaticRings: | 0 |
