Glycoside
GD008143
Name:
2-{2-[2-(2,4-dihydroxyphenyl)ethyl]-5-hydroxyphenoxy}oxane-3,4,5-triolFormula:
C19H22O8Smiles:
Oc1ccc(CCc2ccc(O)cc2O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(O)c1Aglycone:
Oc1ccc(CCc2ccc(O)cc2O)c(O)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 378.38 | Num_heavy_atoms: | 27 |
| TPSA: | 139.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD06543
Formula: C14H14O4
Smiles:
Oc1ccc(CCc2ccc(O)cc2O)c(O)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.14 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 246.26 | Num_heavy_atoms: | 18 |
| TPSA: | 80.92 | NumAromaticRings: | 2 |
