Glycoside
GD082277
Name:
NoneFormula:
C16H20O8NClSSmiles:
Cc1c(S(C)(=O)=O)ccc(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1ClAglycone:
Cc1c(S(C)(=O)=O)ccc(C(N)=O)c1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.42 | Num_rotatable_bonds: | 4 |
| MolWt: | 409.84 | Num_heavy_atoms: | 26 |
| TPSA: | 153.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD36952
Formula: C10H10O3NClS
Smiles:
Cc1c(S(C)(=O)=O)ccc(C(N)=O)c1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 247.7 | Num_heavy_atoms: | 15 |
| TPSA: | 77.23 | NumAromaticRings: | 1 |
