Account methyl (S)-2-acetoxy-2-((4R,4aR,6aS,7R,8S,11R,12bS)-4-(furan-3-yl)-4a,7,9,9-tetramethyl-2,10,13-trioxo-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-2H-7,11-methanocycloocta[f]isochromen-8-yl)acetate
- Catalog No. :
- ACQAZM441
- CAS No. :
- 1220508-29-1
- Molecular Formula :
- C29H34O9
- Molecular Weight :
- 526.58
IUPAC Name:methyl (S)-2-acetoxy-2-((4R,4aR,6aS,7R,8S,11R,12bS)-4-(furan-3-yl)-4a,7,9,9-tetramethyl-2,10,13-trioxo-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-2H-7,11-methanocycloocta[f]isochromen-8-yl)acetate
![methyl (S)-2-acetoxy-2-((4R,4aR,6aS,7R,8S,11R,12bS)-4-(furan-3-yl)-4a,7,9,9-tetramethyl-2,10,13-trioxo-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-2H-7,11-methanocycloocta[f]isochromen-8-yl)acetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | methyl (S)-2-acetoxy-2-((4R,4aR,6aS,7R,8S,11R,12bS)-4-(furan-3-yl)-4a,7,9,9-tetramethyl-2,10,13-trioxo-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-2H-7,11-methanocycloocta[f]isochromen-8-yl)acetate |
|---|---|
| IUPAC Name | methyl (S)-2-acetoxy-2-((4R,4aR,6aS,7R,8S,11R,12bS)-4-(furan-3-yl)-4a,7,9,9-tetramethyl-2,10,13-trioxo-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-2H-7,11-methanocycloocta[f]isochromen-8-yl)acetate |
| MDL No. | MFCD20261041 |
| Molecular Formula | C29H34O9 |
| Molecular Weight | 526.58 |
| SMILES | COC(=O)[C@@H](OC(C)=O)[C@H]1C(C)(C)C(=O)[C@H]2C=C3[C@@H]4CC(=O)O[C@@H](C5=COC=C5)[C@]4(C)CC[C@@H]3[C@@]1(C)C2=O |
| InChI Key | YEAXMHFWUBJUEN-JLICFTCYSA-N |
| Synonym | Khayaleid E;Khayalenoid E;7,11-Methano-2H-cycloocta[f][2]benzopyran-8-acetic acid, α-(acetyloxy)-4-(3-furanyl)-1,4,4a,5,6,6a,7,8,9,10,11,12b-dodecahydro-4a,7,9,9-tetramethyl-2,10,13-trioxo-, methyl ester, (αS,4R,4aR,6aS,7R,8S,11S,12bS)-;Khayalenoid |
| CAS No. | 1220508-29-1 |
Synthetic Route by SureRoute
2. ACQAZM441 Molecular Building Block Synthetic Route
methyl 2-(4-(furan-3-yl)-4a,7a,9,9-tetramethyl-13-methylene-2,10-dioxododecahydro-4H-7,12a-methanobenzo[b]pyrano[3,4-g]oxocin-8-yl)-2-hydroxyacetate
(1S,3aS,4aR,4bR,6aR,11aR,11bR,13aS)-1-(furan-3-yl)-4b,7,7,11a,13a-pentamethyl-1,6a,7,11a,11b,12,13,13a-octahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromene-3,5,9(3aH,4bH,6H)-trione
(1S,3AS,4aR,4bR,6aR,11aR,11bR,12S,13aS)-1-(furan-3-yl)-12-hydroxy-4b,7,7,11a,13a-pentamethyl-1,6a,7,11a,11b,12,13,13a-octahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromene-3,5,9(3aH,4bH,6H)-trione