Glycoside
GD007697
Name:
NoneFormula:
C22H24O5NF3Smiles:
OC[C@@H]1O[C@H](c2ccc3c(c2)[C@H](c2ccc(C(F)(F)F)cc2)NCC3)[C@H](O)[C@H](O)[C@H]1OAglycone:
FC(F)(F)c1ccc(C2NCCc3ccccc32)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 439.43 | Num_heavy_atoms: | 31 |
| TPSA: | 102.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD06239
Formula: C16H14NF3
Smiles:
FC(F)(F)c1ccc(C2NCCc3ccccc32)cc1| HBA: | 1 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 1 |
| MolWt: | 277.29 | Num_heavy_atoms: | 20 |
| TPSA: | 12.03 | NumAromaticRings: | 2 |
