Glycoside
GD053229
Name:
2-[2-hydroxy-1-(4-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H24O8Smiles:
COc1ccc([C@H](O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](C)O)cc1Aglycone:
COc1ccc(C(O)C(C)O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 344.36 | Num_heavy_atoms: | 24 |
| TPSA: | 128.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD27230
Formula: C10H14O3
Smiles:
COc1ccc(C(O)C(C)O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 182.22 | Num_heavy_atoms: | 13 |
| TPSA: | 49.69 | NumAromaticRings: | 1 |
