Glycoside
GD016642
Name:
NoneFormula:
C11H15O6NSSmiles:
O=C(N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1cccs1Aglycone:
NC(=O)c1cccs1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 289.31 | Num_heavy_atoms: | 19 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD10017
Formula: C5H5ONS
Smiles:
NC(=O)c1cccs1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 1 |
| MolWt: | 127.17 | Num_heavy_atoms: | 8 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
