Glycoside
GD000079
Name:
2-[2,6-dimethoxy-4-(1,2,3-trihydroxypropyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C17H26O11Smiles:
COc1cc([C@H](O)[C@H](O)CO)cc(OC)c1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(C(O)C(O)CO)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | -2.73 | Num_rotatable_bonds: | 8 |
| MolWt: | 406.38 | Num_heavy_atoms: | 28 |
| TPSA: | 178.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD00104
Formula: C11H16O6
Smiles:
COc1cc(C(O)C(O)CO)cc(OC)c1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 244.24 | Num_heavy_atoms: | 17 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
