Glycoside
GD075494
Name:
NoneFormula:
C14H20O7N3ClSSmiles:
CCc1c(Cl)nc(S(C)(=O)=O)nc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCc1c(N)nc(S(C)(=O)=O)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 397.84 | Num_heavy_atoms: | 25 |
| TPSA: | 162.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD34979
Formula: C8H10O2N3ClS
Smiles:
CCc1c(N)nc(S(C)(=O)=O)nc1Cl| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 235.7 | Num_heavy_atoms: | 14 |
| TPSA: | 85.94 | NumAromaticRings: | 1 |
