Glycoside
GD088186
Name:
NoneFormula:
C20H23O8NSSmiles:
CS(=O)(=O)c1cccc([C@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)c2ccccc2)c1Aglycone:
CS(=O)(=O)c1cccc(C(N)c2ccccc2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 9 |
| MolWt: | 437.47 | Num_heavy_atoms: | 30 |
| TPSA: | 161.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD38606
Formula: C14H15O2NS
Smiles:
CS(=O)(=O)c1cccc(C(N)c2ccccc2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 261.35 | Num_heavy_atoms: | 18 |
| TPSA: | 60.16 | NumAromaticRings: | 2 |
