Glycoside
GD066895
Name:
NoneFormula:
C13H22O6N2F3Smiles:
O=C(N1CCC([NH2+][C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1)C(F)(F)FAglycone:
[NH3+]C1CCN(C(=O)C(F)(F)F)CC1Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | -3.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 359.32 | Num_heavy_atoms: | 24 |
| TPSA: | 127.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD31976
Formula: C7H12ON2F3
Smiles:
[NH3+]C1CCN(C(=O)C(F)(F)F)CC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.86 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 0 |
| MolWt: | 197.18 | Num_heavy_atoms: | 13 |
| TPSA: | 47.95 | NumAromaticRings: | 0 |
