Glycoside
GD140124
Name:
7-ethoxy-5-hydroxy-3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-oneFormula:
C23H24O10Smiles:
CCOc1cc(O)c2c(=O)c(-c3ccc(OC4OC(CO)C(O)C(O)C4O)cc3)coc2c1Aglycone:
CCOc1cc(O)c2c(=O)c(-c3ccc(O)cc3)coc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 460.44 | Num_heavy_atoms: | 33 |
| TPSA: | 159.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD56498
Formula: C17H14O5
Smiles:
CCOc1cc(O)c2c(=O)c(-c3ccc(O)cc3)coc2c1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.29 | Num_heavy_atoms: | 22 |
| TPSA: | 79.9 | NumAromaticRings: | 3 |
