Glycoside
GD074755
Name:
NoneFormula:
C15H27O9NSSmiles:
COCCC1(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CCS(=O)(=O)CC1Aglycone:
COCCC1(C(N)=O)CCS(=O)(=O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | -2.87 | Num_rotatable_bonds: | 6 |
| MolWt: | 397.45 | Num_heavy_atoms: | 26 |
| TPSA: | 162.62 | NumAromaticRings: | 0 |
Unique Aglycone
AD34561
Formula: C9H17O4NS
Smiles:
COCCC1(C(N)=O)CCS(=O)(=O)CC1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.89 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 235.3 | Num_heavy_atoms: | 15 |
| TPSA: | 86.46 | NumAromaticRings: | 0 |
