Glycoside
GD022674
Name:
NoneFormula:
C29H34O6NF3Smiles:
CO[C@@H]1[C@H](O)[C@H](O)[C@H](Oc2ccc(C3CC=CCC3NC(C)=O)c(-c3cccc(C(F)(F)F)c3)c2)OC1(C)CAglycone:
CC(=O)NC1CC=CCC1c1ccc(O)cc1-c1cccc(C(F)(F)F)c1Sugarmoiety:
COC1C(O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.48 |
| AlogP: | 4.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 549.59 | Num_heavy_atoms: | 39 |
| TPSA: | 97.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD15347
Formula: C21H20O2NF3
Smiles:
CC(=O)NC1CC=CCC1c1ccc(O)cc1-c1cccc(C(F)(F)F)c1| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 5.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 375.39 | Num_heavy_atoms: | 27 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
