Glycoside
GD088163
Name:
NoneFormula:
C17H24O9N2SSmiles:
O=C(NCc1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCc1cccc(S(=O)(=O)N2CCOCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -3.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 432.45 | Num_heavy_atoms: | 29 |
| TPSA: | 173.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD38604
Formula: C11H16O3N2S
Smiles:
NCc1cccc(S(=O)(=O)N2CCOCC2)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 256.33 | Num_heavy_atoms: | 17 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
