Glycoside
GD080939
Name:
NoneFormula:
C16H24O8N2SSmiles:
CC(=O)Nc1ccc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
CC(=O)Nc1ccc(S(=O)(=O)NCCO)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 404.44 | Num_heavy_atoms: | 27 |
| TPSA: | 154.42 | NumAromaticRings: | 1 |
Unique Aglycone
AD36542
Formula: C10H14O4N2S
Smiles:
CC(=O)Nc1ccc(S(=O)(=O)NCCO)cc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 258.3 | Num_heavy_atoms: | 17 |
| TPSA: | 95.5 | NumAromaticRings: | 1 |
