Glycoside
GD032661
Name:
BartsiosideFormula:
C15H22O8Smiles:
OCC1=CC[C@@H]2C=CO[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]12Aglycone:
OCC1=CCC2C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 330.33 | Num_heavy_atoms: | 23 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD20912
Formula: C9H12O3
Smiles:
OCC1=CCC2C=COC(O)C12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 168.19 | Num_heavy_atoms: | 12 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
