Glycoside
GD001718
Name:
Adinoside AFormula:
C20H28O11Smiles:
C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C=CCC(=O)OCAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1C=CCC(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 8 |
| MolWt: | 444.43 | Num_heavy_atoms: | 31 |
| TPSA: | 161.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD01691
Formula: C14H18O6
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1C=CCC(=O)OC| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 282.29 | Num_heavy_atoms: | 20 |
| TPSA: | 82.06 | NumAromaticRings: | 0 |
