Glycoside
GD089469
Name:
NoneFormula:
C21H31O6N2F2Smiles:
CC(C)(C)[N@H+]1C[C@@H](C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](c2ccc(F)cc2F)C1Aglycone:
CC(C)(C)[NH+]1CC(C(N)=O)C(c2ccc(F)cc2F)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 445.48 | Num_heavy_atoms: | 31 |
| TPSA: | 123.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD39029
Formula: C15H21ON2F2
Smiles:
CC(C)(C)[NH+]1CC(C(N)=O)C(c2ccc(F)cc2F)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 2 |
| MolWt: | 283.34 | Num_heavy_atoms: | 20 |
| TPSA: | 47.53 | NumAromaticRings: | 1 |
