Glycoside
GD123615
Name:
2-{[4-(4-hydroxy-3-methoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H26O10Smiles:
COc1cc(C2OCC3C(OC4OC(CO)C(O)C(O)C4O)OCC23)ccc1OAglycone:
COc1cc(C2OCC3C(O)OCC23)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 414.41 | Num_heavy_atoms: | 29 |
| TPSA: | 147.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD49901
Formula: C13H16O5
Smiles:
COc1cc(C2OCC3C(O)OCC23)ccc1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 252.27 | Num_heavy_atoms: | 18 |
| TPSA: | 68.15 | NumAromaticRings: | 1 |
