Glycoside
GD074811
Name:
NoneFormula:
C14H21O7NS2Smiles:
O=S(=O)(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cc2c(s1)CCCC2Aglycone:
NS(=O)(=O)c1cc2c(s1)CCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 379.46 | Num_heavy_atoms: | 24 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD34594
Formula: C8H11O2NS2
Smiles:
NS(=O)(=O)c1cc2c(s1)CCCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 217.31 | Num_heavy_atoms: | 13 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
