Glycoside
GD058790
Name:
NoneFormula:
C13H19O8NSSmiles:
COc1cccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c1Aglycone:
COc1cccc(S(N)(=O)=O)c1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 9 |
| MolWt: | 349.36 | Num_heavy_atoms: | 23 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD28798
Formula: C7H9O3NS
Smiles:
COc1cccc(S(N)(=O)=O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 187.22 | Num_heavy_atoms: | 12 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
