Glycoside
GD068921
Name:
NoneFormula:
C18H22O6NClSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C1(c2cccc(Cl)c2)CCC1Aglycone:
NC(=O)C1(c2cccc(Cl)c2)CCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 371.82 | Num_heavy_atoms: | 25 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD32649
Formula: C12H12ONCl
Smiles:
NC(=O)C1(c2cccc(Cl)c2)CCC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.36 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 2 |
| MolWt: | 209.68 | Num_heavy_atoms: | 14 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
