Glycoside
GD026945
Name:
CITRUSOSIDE AFormula:
C21H36O7Smiles:
CC(C)=CCC[C@H](C)CC=CC(=O)OC[C@@H]1O[C@H](OC(C)C)[C@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)C=CCC(C)CCC=C(C)CSugarmoiety:
CC(C)OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.76 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 10 |
| MolWt: | 400.51 | Num_heavy_atoms: | 28 |
| TPSA: | 105.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD17738
Formula: C13H22O2
Smiles:
COC(=O)C=CCC(C)CCC=C(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.62 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 210.32 | Num_heavy_atoms: | 15 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
