Glycoside
GD152892
Name:
4,5-dihydroxy-2-[3-hydroxy-2-(5-hydroxy-7-methoxy-4-oxo-4H-chromen-2-yl)phenoxy]-6-(hydroxymethyl)oxan-3-yl acetateFormula:
C24H24O12Smiles:
COc1cc(O)c2c(=O)cc(-c3c(O)cccc3OC3OC(CO)C(O)C(O)C3OC(C)=O)oc2c1Aglycone:
COc1cc(O)c2c(=O)cc(-c3c(O)cccc3O)oc2c1Sugarmoiety:
CC(=O)OC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 6 |
| MolWt: | 504.44 | Num_heavy_atoms: | 36 |
| TPSA: | 185.35 | NumAromaticRings: | 3 |
Unique Aglycone
AD49553
Formula: C16H12O6
Smiles:
COc1cc(O)c2c(=O)cc(-c3c(O)cccc3O)oc2c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.27 | Num_heavy_atoms: | 22 |
| TPSA: | 100.13 | NumAromaticRings: | 3 |
