Glycoside
GD150589
Name:
4,5-dihydroxy-2-[(3,7,11-trimethyldodeca-1,6,10-trien-3-yl)oxy]oxan-3-yl acetateFormula:
C22H36O6Smiles:
C=CC(C)(CCC=C(C)CCC=C(C)C)OC1OCC(O)C(O)C1OC(C)=OAglycone:
C=CC(C)(O)CCC=C(C)CCC=C(C)CSugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | 3.43 | Num_rotatable_bonds: | 10 |
| MolWt: | 396.52 | Num_heavy_atoms: | 28 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD45694
Formula: C15H26O
Smiles:
C=CC(C)(O)CCC=C(C)CCC=C(C)C| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 222.37 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
