Glycoside
GD147215
Name:
3-methyl-2-oxo-10-{[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)oxy]methyl}-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-6-carbaldehydeFormula:
C21H30O9Smiles:
COC1OC(OCC2=CC3OC(=O)C(C)C3CCC(C=O)=CCC2)C(O)C(O)C1OAglycone:
CC1C(=O)OC2C=C(CO)CCC=C(C=O)CCC21Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.71 |
| AlogP: | 0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 426.46 | Num_heavy_atoms: | 30 |
| TPSA: | 131.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD49763
Formula: C15H20O4
Smiles:
CC1C(=O)OC2C=C(CO)CCC=C(C=O)CCC21| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 264.32 | Num_heavy_atoms: | 19 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
