Glycoside
GD119934
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 4-[2-(4-hydroxyphenyl)ethyl]-1-benzofuran-2-carboxylateFormula:
C23H24O9Smiles:
O=C(OC1OC(CO)C(O)C(O)C1O)c1cc2c(CCc3ccc(O)cc3)cccc2o1Aglycone:
O=C(O)c1cc2c(CCc3ccc(O)cc3)cccc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.44 | Num_heavy_atoms: | 32 |
| TPSA: | 149.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD48131
Formula: C17H14O4
Smiles:
O=C(O)c1cc2c(CCc3ccc(O)cc3)cccc2o1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 282.3 | Num_heavy_atoms: | 21 |
| TPSA: | 70.67 | NumAromaticRings: | 3 |
