Glycoside
GD100353
Name:
NoneFormula:
C22H33O6N2F2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2CC(F)(F)CC[N@H+]2[C@H](C)c2ccccc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(c1ccccc1)[NH+]1CCC(F)(F)CC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 7 |
| MolWt: | 459.51 | Num_heavy_atoms: | 32 |
| TPSA: | 112.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD42400
Formula: C16H23O2N2F2
Smiles:
CC(c1ccccc1)[NH+]1CCC(F)(F)CC1C(=O)NCCO| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.56 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 313.37 | Num_heavy_atoms: | 22 |
| TPSA: | 53.77 | NumAromaticRings: | 1 |
