Inulicin
3-(4-hydroxy-5,7-dimethyl-3-methylidene-2-oxo-4,5,8,8a-tetrahydro-3aH-cyclohepta[b]furan-6-yl)propyl acetate
Also Known As: Inulicin|1-O-Acetylbritannilactone|AC1L1W0C|Britannilactone 1-O-acetate|orb1989994|BRN 1292533|5-18-03-00024 (Beilstein Handbook Reference)|AH-034/20656026|T131386|2H-Cyclohepta(b)furan-2-one, 3,3a,4,5,8,8a-hexahydro-4-hydroxy-6-(3-hydroxypropyl)-5,7-dimethyl-3-methylene-, 6-acetate, (+)-|3-(4-hydroxy-5,7-dimethyl-3-methylidene-2-oxo-4,5,8,8a-tetrahydro-3aH-cyclohepta[b]furan-6-yl)propyl acetate|3-{4-HYDROXY-5,7-DIMETHYL-3-METHYLIDENE-2-OXO-2H,3H,3AH,4H,5H,8H,8AH-CYCLOHEPTA[B]FURAN-6-YL}PROPYL ACETATE
| Molecular Formula | C17H24O5 |
|---|---|
| Molecular Weight | 308.16238 g/mol |
| LogP | 2.14 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.16238 |
| Heavy Atoms | 22 |
| Complexity | 519.1 |
Chemical Identifiers
| CAS Number | 33627-41-7 |
|---|---|
| SMILES | CC1C(C2C(CC(=C1CCCOC(=O)C)C)OC(=O)C2=C)O |
Product Overview
Inulicin (CAS 33627-41-7), with molecular formula C17H24O5 and molecular weight 308.16238 g/mol. IUPAC: 3-(4-hydroxy-5,7-dimethyl-3-methylidene-2-oxo-4,5,8,8a-tetrahydro-3aH-cyclohepta[b]furan-6-yl)propyl acetate.
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