Glycoside
GD111444
Name:
NoneFormula:
C16H13O7F17Smiles:
O=C(O)[C@H]1O[C@@H](OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)FSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 11 |
| MolWt: | 640.24 | Num_heavy_atoms: | 40 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD44718
Formula: C10H5OF17
Smiles:
OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 5.38 | Num_rotatable_bonds: | 8 |
| MolWt: | 464.11 | Num_heavy_atoms: | 28 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
