Glycoside
GD147463
Name:
5-hydroxy-6,7-dimethoxy-2-(2,4,5-trimethoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-oneFormula:
C26H30O14Smiles:
COc1cc(-c2cc(=O)c3c(O)c(OC)c(OC)cc3o2)c(OC)c(OC2OC(CO)C(O)C(O)C2O)c1OCAglycone:
COc1cc(-c2cc(=O)c3c(O)c(OC)c(OC)cc3o2)c(OC)c(O)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 9 |
| MolWt: | 566.51 | Num_heavy_atoms: | 40 |
| TPSA: | 195.97 | NumAromaticRings: | 3 |
Unique Aglycone
AD59055
Formula: C20H20O9
Smiles:
COc1cc(-c2cc(=O)c3c(O)c(OC)c(OC)cc3o2)c(OC)c(O)c1OC| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.91 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.37 | Num_heavy_atoms: | 29 |
| TPSA: | 116.82 | NumAromaticRings: | 3 |
