Glycoside
GD051306
Name:
2-(hydroxymethyl)-6-[(4-hydroxynon-6-en-2-yl)oxy]oxane-3,4,5-triolFormula:
C15H28O7Smiles:
CC/C=C\C[C@H](O)C[C@@H](C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
CCC=CCC(O)CC(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 8 |
| MolWt: | 320.38 | Num_heavy_atoms: | 22 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD26843
Formula: C9H18O2
Smiles:
CCC=CCC(O)CC(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 158.24 | Num_heavy_atoms: | 11 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
