Glycoside
GD026780
Name:
Kouitchenside HFormula:
C27H32O16Smiles:
COc1cc(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c2c(=O)c3c(O)ccc(OC)c3oc2c1Aglycone:
COc1cc(O)c2c(=O)c3c(O)ccc(OC)c3oc2c1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 612.54 | Num_heavy_atoms: | 43 |
| TPSA: | 247.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD17639
Formula: C15H12O6
Smiles:
COc1cc(O)c2c(=O)c3c(O)ccc(OC)c3oc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.25 | Num_heavy_atoms: | 21 |
| TPSA: | 89.13 | NumAromaticRings: | 3 |
