Glycoside
GD064206
Name:
NoneFormula:
C13H23O8NSSmiles:
CC1(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CCS(=O)(=O)CC1Aglycone:
CC1(C(N)=O)CCS(=O)(=O)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | -2.88 | Num_rotatable_bonds: | 3 |
| MolWt: | 353.39 | Num_heavy_atoms: | 23 |
| TPSA: | 153.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD30896
Formula: C7H13O3NS
Smiles:
CC1(C(N)=O)CCS(=O)(=O)CC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 1 |
| MolWt: | 191.25 | Num_heavy_atoms: | 12 |
| TPSA: | 77.23 | NumAromaticRings: | 0 |
