Glycoside
GD028803
Name:
3,4-dihydroxy-5-(1,2,3,4-tetrahydroxybutyl)oxolan-2-oneFormula:
C8H14O8Smiles:
O=C1O[C@H]([C@H](O)[C@H](O)[C@H](O)CO)[C@H](O)[C@H]1OAglycone:
O=C1OCC(O)C1OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -4.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 238.19 | Num_heavy_atoms: | 16 |
| TPSA: | 147.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD13705
Formula: C4H6O4
Smiles:
O=C1OCC(O)C1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -1.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 118.09 | Num_heavy_atoms: | 8 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
