Glycoside
GD045146
Name:
NoneFormula:
C11H19O6NSSmiles:
C=CCSCC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
C=CCSCC(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 293.34 | Num_heavy_atoms: | 19 |
| TPSA: | 119.25 | NumAromaticRings: | 0 |
Unique Aglycone
AD25208
Formula: C5H9ONS
Smiles:
C=CCSCC(N)=O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 131.2 | Num_heavy_atoms: | 8 |
| TPSA: | 43.09 | NumAromaticRings: | 0 |
