Glycoside
GD067121
Name:
NoneFormula:
C10H19O9NS2Smiles:
C=CC/C(=N/OS(O)(O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
C=CCC(S)=NOS(O)(O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.7 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.39 | Num_heavy_atoms: | 22 |
| TPSA: | 172.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD32078
Formula: C4H9O4NS2
Smiles:
C=CCC(S)=NOS(O)(O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 4 |
| MolWt: | 199.25 | Num_heavy_atoms: | 11 |
| TPSA: | 82.28 | NumAromaticRings: | 0 |
