Glycoside
GD012327
Name:
NoneFormula:
C26H44O12Smiles:
CCCCCCCCCCCCCC(=O)OC[C@H](O)[C@@H]1OC(O)=C(O[C@@H]2OC(CO)[C@H](O)C(O)[C@H]2O)C1=OAglycone:
CCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.85 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 18 |
| MolWt: | 548.63 | Num_heavy_atoms: | 38 |
| TPSA: | 192.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD09314
Formula: C20H34O7
Smiles:
CCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 3.84 | Num_rotatable_bonds: | 15 |
| MolWt: | 386.49 | Num_heavy_atoms: | 27 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
