Glycoside
GD069894
Name:
NoneFormula:
C16H21O5NF3Smiles:
O=C[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c2C1)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
[NH3+]C1CCc2cc(F)c(F)c(F)c2C1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 7 |
| MolWt: | 364.34 | Num_heavy_atoms: | 25 |
| TPSA: | 114.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD33105
Formula: C10H11NF3
Smiles:
[NH3+]C1CCc2cc(F)c(F)c(F)c2C1| HBA: | 1 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 202.2 | Num_heavy_atoms: | 14 |
| TPSA: | 27.64 | NumAromaticRings: | 1 |
