Glycoside
GD099890
Name:
Cuneatin 7-GlucosideFormula:
C23H22O11Smiles:
COc1cc2c(cc1-c1coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c1=O)OCO2Aglycone:
COc1cc2c(cc1-c1coc3cc(O)ccc3c1=O)OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 5 |
| MolWt: | 474.42 | Num_heavy_atoms: | 34 |
| TPSA: | 157.28 | NumAromaticRings: | 3 |
Unique Aglycone
AD42323
Formula: C17H12O6
Smiles:
COc1cc2c(cc1-c1coc3cc(O)ccc3c1=O)OCO2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.28 | Num_heavy_atoms: | 23 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
