Glycoside
GD069009
Name:
NoneFormula:
C17H19O6NSSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cccc(-c2ccsc2)c1Aglycone:
NC(=O)c1cccc(-c2ccsc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 365.41 | Num_heavy_atoms: | 25 |
| TPSA: | 119.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD32704
Formula: C11H9ONS
Smiles:
NC(=O)c1cccc(-c2ccsc2)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 203.27 | Num_heavy_atoms: | 14 |
| TPSA: | 43.09 | NumAromaticRings: | 2 |
