Glycoside
GD128656
Name:
6-[(4-acetylphenoxy)methyl]-3-methylidene-10-{[(3,4,5-trihydroxy-6-methoxyoxan-2-yl)oxy]methyl}-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-2-oneFormula:
C29H36O10Smiles:
C=C1C(=O)OC2C=C(COC3OC(OC)C(O)C(O)C3O)CCC=C(COc3ccc(C(C)=O)cc3)CCC12Aglycone:
C=C1C(=O)OC2C=C(CO)CCC=C(COc3ccc(C(C)=O)cc3)CCC12Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.52 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 8 |
| MolWt: | 544.6 | Num_heavy_atoms: | 39 |
| TPSA: | 140.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD52113
Formula: C23H26O5
Smiles:
C=C1C(=O)OC2C=C(CO)CCC=C(COc3ccc(C(C)=O)cc3)CCC12| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.39 |
| AlogP: | 3.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 382.46 | Num_heavy_atoms: | 28 |
| TPSA: | 72.83 | NumAromaticRings: | 1 |
