Glycoside
GD045581
Name:
NoneFormula:
C12H15O5NSSmiles:
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)c1nc2ccccc2s1Aglycone:
c1ccc2scnc2c1Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 285.32 | Num_heavy_atoms: | 19 |
| TPSA: | 114.04 | NumAromaticRings: | 2 |
Unique Aglycone
AD02122
Formula: C7H5NS
Smiles:
c1ccc2scnc2c1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.3 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.19 | Num_heavy_atoms: | 9 |
| TPSA: | 12.89 | NumAromaticRings: | 2 |
