Glycoside
GD120243
Name:
5-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)-2,5-dihydrofuran-2-oneFormula:
C12H18O8Smiles:
CC(OC1OC(CO)C(O)C(O)C1O)C1C=CC(=O)O1Aglycone:
CC(O)C1C=CC(=O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.27 | Num_heavy_atoms: | 20 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD48277
Formula: C6H8O3
Smiles:
CC(O)C1C=CC(=O)O1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 128.13 | Num_heavy_atoms: | 9 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
