Glycoside
GD062671
Name:
5-{[6-ethoxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-3-hydroxy-3-methyl-5-oxopentanoic acidFormula:
C14H24O10Smiles:
CCO[C@@H]1O[C@H](CO)[C@@H](OC(=O)C[C@@](C)(O)CC(=O)O)[C@H](O)[C@H]1OAglycone:
CC(O)(CC(=O)O)CC(=O)OSugarmoiety:
CCOC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 8 |
| MolWt: | 352.34 | Num_heavy_atoms: | 24 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD17237
Formula: C6H10O5
Smiles:
CC(O)(CC(=O)O)CC(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 162.14 | Num_heavy_atoms: | 11 |
| TPSA: | 94.83 | NumAromaticRings: | 0 |
