Glycoside
GD030525
Name:
REHMAGLUTOSIDE AFormula:
C24H30O10Smiles:
C[C@]1(O)C[C@H](OC(=O)C=Cc2ccccc2)[C@@H]2C=CO[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]21Aglycone:
CC1(O)CC(OC(=O)C=Cc2ccccc2)C2C=COC(O)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 478.49 | Num_heavy_atoms: | 34 |
| TPSA: | 155.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD19748
Formula: C18H20O5
Smiles:
CC1(O)CC(OC(=O)C=Cc2ccccc2)C2C=COC(O)C21| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.39 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.35 | Num_heavy_atoms: | 23 |
| TPSA: | 75.99 | NumAromaticRings: | 1 |
