Glycoside
GD011917
Name:
NoneFormula:
C19H22O6NClSSmiles:
CCOc1cnc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)s1Aglycone:
CCOc1cnc(Cc2ccccc2Cl)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.9 | Num_heavy_atoms: | 27 |
| TPSA: | 112.27 | NumAromaticRings: | 2 |
Unique Aglycone
AD09033
Formula: C13H12ONClS
Smiles:
CCOc1cnc(Cc2ccccc2Cl)s1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 3.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 253.75 | Num_heavy_atoms: | 16 |
| TPSA: | 22.12 | NumAromaticRings: | 2 |
