Glycoside
GD014222
Name:
NoneFormula:
C14H18O4NF3Smiles:
OC[C@@H]1O[C@H](CNCc2cccc(C(F)(F)F)c2)[C@H](O)[C@H]1OAglycone:
CNCc1cccc(C(F)(F)F)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 321.3 | Num_heavy_atoms: | 22 |
| TPSA: | 81.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD10487
Formula: C9H10NF3
Smiles:
CNCc1cccc(C(F)(F)F)c1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 189.18 | Num_heavy_atoms: | 13 |
| TPSA: | 12.03 | NumAromaticRings: | 1 |
