Glycoside
GD092032
Name:
NoneFormula:
C19H28O6N2F3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)C[C@H]([NH3+])Cc2cccc(C(F)(F)F)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C(CC(=O)NCCO)Cc1cccc(C(F)(F)F)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 8 |
| MolWt: | 437.44 | Num_heavy_atoms: | 30 |
| TPSA: | 135.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD40169
Formula: C13H18O2N2F3
Smiles:
[NH3+]C(CC(=O)NCCO)Cc1cccc(C(F)(F)F)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 291.29 | Num_heavy_atoms: | 20 |
| TPSA: | 76.97 | NumAromaticRings: | 1 |
