Glycoside
GD076421
Name:
NoneFormula:
C15H23O8NSSmiles:
COc1cc(C)c(C)cc1S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
COc1cc(C)c(C)cc1S(N)(=O)=OSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 9 |
| MolWt: | 377.42 | Num_heavy_atoms: | 25 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD34274
Formula: C9H13O3NS
Smiles:
COc1cc(C)c(C)cc1S(N)(=O)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 215.27 | Num_heavy_atoms: | 14 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
