Glycoside
GD093441
Name:
DiderrosideFormula:
C19H28O13Smiles:
COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]([C@H](C)OC(C)=O)[C@@H]1CC(=O)OAglycone:
COC(=O)C1=COC(O)C(C(C)OC(C)=O)C1CC(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.74 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 8 |
| MolWt: | 464.42 | Num_heavy_atoms: | 32 |
| TPSA: | 198.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD40408
Formula: C13H18O8
Smiles:
COC(=O)C1=COC(O)C(C(C)OC(C)=O)C1CC(=O)O| HBA: | 8 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 302.28 | Num_heavy_atoms: | 21 |
| TPSA: | 119.36 | NumAromaticRings: | 0 |
