Glycoside
GD060188
Name:
NoneFormula:
C13H17O5N2ClSSmiles:
CSc1ccc(Cl)nc1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CSc1ccc(Cl)nc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 336.8 | Num_heavy_atoms: | 21 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD29746
Formula: C7H7N2ClS
Smiles:
CSc1ccc(Cl)nc1N| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 174.66 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
