Glycoside
GD152264
Name:
2-{2,6-dimethoxy-4-[4-(3,4,5-trimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C29H38O13Smiles:
COc1cc(C2OCC3C(c4cc(OC)c(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OCC23)cc(OC)c1OCAglycone:
COc1cc(C2OCC3C(c4cc(OC)c(OC)c(OC)c4)OCC23)cc(OC)c1OSugarmoiety:
CO.OCC1OOC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 10 |
| MolWt: | 594.61 | Num_heavy_atoms: | 42 |
| TPSA: | 163.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD60643
Formula: C23H28O8
Smiles:
COc1cc(C2OCC3C(c4cc(OC)c(OC)c(OC)c4)OCC23)cc(OC)c1O| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.48 |
| AlogP: | 3.51 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.47 | Num_heavy_atoms: | 31 |
| TPSA: | 84.84 | NumAromaticRings: | 2 |
