Glycoside
GD118005
Name:
Picrodendrioside AFormula:
C21H30O10Smiles:
CC(C)C1C2OC(=O)C1C1C(O)C=C(COC3OC(CO)C(O)C(O)C3O)C1(C)C2=OAglycone:
CC(C)C1C2OC(=O)C1C1C(O)C=C(CO)C1(C)C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | -1.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 442.46 | Num_heavy_atoms: | 31 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD47121
Formula: C15H20O5
Smiles:
CC(C)C1C2OC(=O)C1C1C(O)C=C(CO)C1(C)C2=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 2 |
| MolWt: | 280.32 | Num_heavy_atoms: | 20 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
