Glycoside
GD029523
Name:
Kouitchenside GFormula:
C27H32O15Smiles:
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)c3cccc(OC)c3oc2c1Aglycone:
COc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 596.54 | Num_heavy_atoms: | 42 |
| TPSA: | 227.2 | NumAromaticRings: | 3 |
Unique Aglycone
AD19197
Formula: C15H12O5
Smiles:
COc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.13 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
