Glycoside
GD019394
Name:
5-(1,2-dihydroxyethyl)-4-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,5-dihydrofuran-2-oneFormula:
C12H18O11Smiles:
O=C1O[C@H]([C@H](O)CO)C(O)=C1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=C1OC(C(O)CO)C(O)=C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.75 |
| AlogP: | -4.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.26 | Num_heavy_atoms: | 23 |
| TPSA: | 186.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD13542
Formula: C6H8O6
Smiles:
O=C1OC(C(O)CO)C(O)=C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.12 | Num_heavy_atoms: | 12 |
| TPSA: | 107.22 | NumAromaticRings: | 0 |
