Glycoside
GD078707
Name:
NoneFormula:
C18H25O5NF3Smiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@H]2CCc3cc(F)c(F)c(F)c3C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCC[NH2+]C1CCc2cc(F)c(F)c(F)c2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 392.39 | Num_heavy_atoms: | 27 |
| TPSA: | 95.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD36175
Formula: C12H15ONF3
Smiles:
OCC[NH2+]C1CCc2cc(F)c(F)c(F)c2C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 246.25 | Num_heavy_atoms: | 17 |
| TPSA: | 36.84 | NumAromaticRings: | 1 |
