Glycoside
GD088532
Name:
NoneFormula:
C19H27O9NSSmiles:
CCS(=O)(=O)c1ccc(OCC2CC2)c(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CCS(=O)(=O)c1ccc(OCC2CC2)c(C(N)=O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 8 |
| MolWt: | 445.49 | Num_heavy_atoms: | 30 |
| TPSA: | 162.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD38731
Formula: C13H17O4NS
Smiles:
CCS(=O)(=O)c1ccc(OCC2CC2)c(C(N)=O)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 6 |
| MolWt: | 283.35 | Num_heavy_atoms: | 19 |
| TPSA: | 86.46 | NumAromaticRings: | 1 |
