Glycoside
GD139958
Name:
OrientalosideFormula:
C25H32O13Smiles:
CC(=O)c1c(C)cc2cccc(OC3OC(CO)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)c2c1OAglycone:
CC(=O)c1c(C)cc2cccc(O)c2c1OSugarmoiety:
OCC1OC(OC2C(O)C(O)OC(CO)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.56 |
| AlogP: | -1.94 | Num_rotatable_bonds: | 7 |
| MolWt: | 540.52 | Num_heavy_atoms: | 38 |
| TPSA: | 215.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD02570
Formula: C13H12O3
Smiles:
CC(=O)c1c(C)cc2cccc(O)c2c1O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 216.24 | Num_heavy_atoms: | 16 |
| TPSA: | 57.53 | NumAromaticRings: | 2 |
