Glycoside
GD024277
Name:
Stilbostemin I 2''-Beta-D-GlucopyranosideFormula:
C22H28O9Smiles:
COc1cc(OC)cc(C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C(O)c2ccccc2)c1Aglycone:
COc1cc(OC)cc(C(O)C(O)c2ccccc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 8 |
| MolWt: | 436.46 | Num_heavy_atoms: | 31 |
| TPSA: | 138.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD16218
Formula: C16H18O4
Smiles:
COc1cc(OC)cc(C(O)C(O)c2ccccc2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 274.32 | Num_heavy_atoms: | 20 |
| TPSA: | 58.92 | NumAromaticRings: | 2 |
