Glycoside
GD082316
Name:
NoneFormula:
C16H23O8N2FSSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(NS(C)(=O)=O)c(F)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CS(=O)(=O)Nc1ccc(C(=O)NCCO)cc1FSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 422.43 | Num_heavy_atoms: | 28 |
| TPSA: | 154.42 | NumAromaticRings: | 1 |
Unique Aglycone
AD36977
Formula: C10H13O4N2FS
Smiles:
CS(=O)(=O)Nc1ccc(C(=O)NCCO)cc1F| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 276.29 | Num_heavy_atoms: | 18 |
| TPSA: | 95.5 | NumAromaticRings: | 1 |
