Glycoside
GD092729
Name:
3-(4-methoxyphenoxy)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-oneFormula:
C22H22O10Smiles:
COc1ccc(Oc2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)ccc3c2=O)cc1Aglycone:
COc1ccc(Oc2coc3cc(O)ccc3c2=O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.41 | Num_heavy_atoms: | 32 |
| TPSA: | 148.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD40332
Formula: C16H12O5
Smiles:
COc1ccc(Oc2coc3cc(O)ccc3c2=O)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 284.27 | Num_heavy_atoms: | 21 |
| TPSA: | 68.9 | NumAromaticRings: | 3 |
