Glycoside
GD071102
Name:
NoneFormula:
C14H20O8N2SSmiles:
CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2[C@@H](O)O[C@@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
CC(=O)Nc1ccc(S(N)(=O)=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 376.39 | Num_heavy_atoms: | 25 |
| TPSA: | 165.42 | NumAromaticRings: | 1 |
Unique Aglycone
AD33552
Formula: C8H10O3N2S
Smiles:
CC(=O)Nc1ccc(S(N)(=O)=O)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.25 | Num_heavy_atoms: | 14 |
| TPSA: | 89.26 | NumAromaticRings: | 1 |
