Glycoside
GD137079
Name:
2-{[2-(3,5-dihydroxyphenyl)-1-benzofuran-6-yl]oxy}-6-(hydroxymethyl)-5-methoxyoxane-3,4-diolFormula:
C21H22O9Smiles:
COC1C(CO)OC(Oc2ccc3cc(-c4cc(O)cc(O)c4)oc3c2)C(O)C1OAglycone:
Oc1cc(O)cc(-c2cc3ccc(O)cc3o2)c1Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 418.4 | Num_heavy_atoms: | 30 |
| TPSA: | 141.98 | NumAromaticRings: | 3 |
Unique Aglycone
AD51444
Formula: C14H10O4
Smiles:
Oc1cc(O)cc(-c2cc3ccc(O)cc3o2)c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.23 | Num_heavy_atoms: | 18 |
| TPSA: | 73.83 | NumAromaticRings: | 3 |
