Glycoside
GD156165
Name:
Bidenoside BFormula:
C24H30O10Smiles:
COc1cc(OC)c(C(=O)CCc2ccc(OC3OC(CO)C(O)C(O)C3O)cc2)c(OC)c1Aglycone:
COc1cc(OC)c(C(=O)CCc2ccc(O)cc2)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 10 |
| MolWt: | 478.49 | Num_heavy_atoms: | 34 |
| TPSA: | 144.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD61868
Formula: C18H20O5
Smiles:
COc1cc(OC)c(C(=O)CCc2ccc(O)cc2)c(OC)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.28 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 316.35 | Num_heavy_atoms: | 23 |
| TPSA: | 64.99 | NumAromaticRings: | 2 |
