Glycoside
GD090843
Name:
NoneFormula:
C18H23O7N2F3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CNC(=O)c2cccc(C(F)(F)F)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CNC(=O)c1cccc(C(F)(F)F)c1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 436.38 | Num_heavy_atoms: | 30 |
| TPSA: | 137.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD39548
Formula: C12H13O3N2F3
Smiles:
O=C(CNC(=O)c1cccc(C(F)(F)F)c1)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 5 |
| MolWt: | 290.24 | Num_heavy_atoms: | 20 |
| TPSA: | 78.43 | NumAromaticRings: | 1 |
