Account (3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-acetoxy-2-(hydroxymethyl)but-2-enoate
- Catalog No. :
- ACDRUC310
- CAS No. :
- 109770-86-7
- Molecular Formula :
- C22H28O7
- Molecular Weight :
- 404.46
IUPAC Name:(3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-acetoxy-2-(hydroxymethyl)but-2-enoate
![(3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-acetoxy-2-(hydroxymethyl)but-2-enoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-acetoxy-2-(hydroxymethyl)but-2-enoate |
|---|---|
| IUPAC Name | (3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-acetoxy-2-(hydroxymethyl)but-2-enoate |
| MDL No. | MFCD32644970 |
| Molecular Formula | C22H28O7 |
| Molecular Weight | 404.46 |
| SMILES | C=C1C(=O)O[C@@H]2/C=C(\C)CC/C=C(\C)C[C@@H](OC(=O)/C(=C/COC(C)=O)CO)[C@@H]12 |
| InChI Key | CUJJANFZVGSCSV-UHIMBCETSA-N |
| Synonym | 8beta-(4-Acetoxy-5-hydroxytigloyloxy)costunolide;8β-(4-Acetoxy-5-hydroxytigloyloxy)costunolide;2-Butenoic acid, 4-(acetyloxy)-2-(hydroxymethyl)-, (3aR,4R,6E,10E,11aR)-2,3,3a,4,5,8,9,11a-octahydro-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester, (2E)-;[(3aR,4R,6Z,10Z,11aR)-6,10-Dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-4-acetyloxy-2-(hydroxyme thyl)but-2-enoate |
| CAS No. | 109770-86-7 |
Synthetic Route by SureRoute
2. ACDRUC310 Molecular Building Block Synthetic Route
(3aR,4R,6E,10E,11aR)-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl (E)-4-hydroxy-2-(hydroxymethyl)but-2-enoate
9-acetoxy-6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl 4-hydroxy-2-(hydroxymethyl)but-2-enoate
6,10-dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl 2-(hydroxymethyl)but-2-enoate