Glycoside
GD016856
Name:
2-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H24O10Smiles:
COc1cc([C@H](O)[C@H](CO)O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1OAglycone:
COc1cc(C(O)C(O)CO)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.62 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 7 |
| MolWt: | 376.36 | Num_heavy_atoms: | 26 |
| TPSA: | 169.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD12085
Formula: C10H14O5
Smiles:
COc1cc(C(O)C(O)CO)ccc1O| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 214.22 | Num_heavy_atoms: | 15 |
| TPSA: | 90.15 | NumAromaticRings: | 1 |
