Glycoside
GD137362
Name:
2-{[4-hydroxy-2-(hydroxymethyl)but-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C11H20O8Smiles:
OCC=C(CO)COC1OC(CO)C(O)C(O)C1OAglycone:
OCC=C(CO)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.82 |
| AlogP: | -3.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 280.27 | Num_heavy_atoms: | 19 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD47503
Formula: C5H10O3
Smiles:
OCC=C(CO)CO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 3 |
| MolWt: | 118.13 | Num_heavy_atoms: | 8 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
