Glycoside
GD123430
Name:
4,4-dimethyl-3-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxolan-2-oneFormula:
C12H20O8Smiles:
CC1(C)COC(=O)C1OCC1OC(O)C(O)C(O)C1OAglycone:
COC1C(=O)OCC1(C)CSugarmoiety:
OC1OC(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
AD49808
Formula: C7H12O3
Smiles:
COC1C(=O)OCC1(C)C| HBA: | 3 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.86 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 144.17 | Num_heavy_atoms: | 10 |
| TPSA: | 35.53 | NumAromaticRings: | 0 |
