Glycoside
GD065529
Name:
NoneFormula:
C14H21O8NSSmiles:
COc1cc(S(C)(=O)=O)ccc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COc1cc(S(C)(=O)=O)ccc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 363.39 | Num_heavy_atoms: | 24 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD31514
Formula: C8H11O3NS
Smiles:
COc1cc(S(C)(=O)=O)ccc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 201.25 | Num_heavy_atoms: | 13 |
| TPSA: | 69.39 | NumAromaticRings: | 1 |
