Glycoside
GD102327
Name:
NoneFormula:
C23H27O7N2FSSmiles:
O=C(Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1ccc(N2CCOCC2)cc1FAglycone:
O=C(Nc1ccc(S)cc1)c1ccc(N2CCOCC2)cc1FSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.54 | Num_heavy_atoms: | 34 |
| TPSA: | 131.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD43305
Formula: C17H17O2N2FS
Smiles:
O=C(Nc1ccc(S)cc1)c1ccc(N2CCOCC2)cc1F| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.24 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.4 | Num_heavy_atoms: | 23 |
| TPSA: | 41.57 | NumAromaticRings: | 2 |
