Glycoside
GD076027
Name:
2-(hydroxymethyl)-6-{4-[3-(hydroxymethyl)oxiran-2-yl]-2,6-dimethoxyphenoxy}oxane-3,4,5-triolFormula:
C17H24O10Smiles:
COc1cc([C@@H]2O[C@@H]2CO)cc(OC)c1O[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
COc1cc(C2OC2CO)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 7 |
| MolWt: | 388.37 | Num_heavy_atoms: | 27 |
| TPSA: | 150.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD35156
Formula: C11H14O5
Smiles:
COc1cc(C2OC2CO)cc(OC)c1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 226.23 | Num_heavy_atoms: | 16 |
| TPSA: | 71.45 | NumAromaticRings: | 1 |
