Glycoside
GD067354
Name:
NoneFormula:
C14H19O8NSSmiles:
CC(=O)c1ccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)cc1Aglycone:
CC(=O)c1ccc(S(N)(=O)=O)cc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -2.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 361.37 | Num_heavy_atoms: | 24 |
| TPSA: | 161.23 | NumAromaticRings: | 1 |
Unique Aglycone
AD30820
Formula: C8H9O3NS
Smiles:
CC(=O)c1ccc(S(N)(=O)=O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 199.23 | Num_heavy_atoms: | 13 |
| TPSA: | 77.23 | NumAromaticRings: | 1 |
