Glycoside
GD042881
Name:
4,4-dimethyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-2-oneFormula:
C12H20O8Smiles:
CC1(C)COC(=O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
CC1(C)COC(=O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -2.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.28 | Num_heavy_atoms: | 20 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD24882
Formula: C6H10O3
Smiles:
CC1(C)COC(=O)C1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 130.14 | Num_heavy_atoms: | 9 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
