| SpectraBase Spectrum ID |
APPLBGXwslw |
| Name |
2,7-Dioxabicyclo[3.2.1]octan-3-one, 6-(acetyloxy)-8-[1-[(1,3,3-trimethylcyclohexyl)methylene]-2-propenyl]-, [1.alpha.,5.alpha.,6.alpha.,8S*[Z(R*)]]-(+)- |
| Alternate Name(s) |
(1'Z,1R(*),1''R(*),5S(*),6R(*),8S(*))-8-[1'-ethenyl-2'-(1'',3'',3''-trimethylcyclohexyl)ethenyl]-3-oxo-2,7-dioxabicyclo[3.2.1]oct-6-yl acetate
(1R,5S,6R,8S)-3-oxo-8-{(1Z)-1-[(1,3,3-trimethylcyclohexyl)methylene]-2-propenyl}-2,7-dioxabicyclo[3.2.1]oct-6-yl acetate
(Aplytangene-1) |
| CAS Registry Number |
131622-79-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O5 |
| InChI |
InChI=1S/C21H30O5/c1-6-14(11-21(5)9-7-8-20(3,4)12-21)17-15-10-16(23)25-19(17)26-18(15)24-13(2)22/h6,11,15,17-19H,1,7-10,12H2,2-5H3/b14-11-/t15-,17+,18-,19-,21?/m0/s1 |
| InChIKey |
GXSYTMVMFKTOPV-IWTRFVFCSA-N |
| Molecular Weight |
362.466 g/mol |
| SMILES |
[C@@]12(O[C@](OC(=O)C)([C@@]([C@]1(\C(=C/C1(CC(C)(C)CCC1)C)C=C)[H])([H])CC(O2)=O)[H])[H] |
| SPLASH |
splash10-052f-9200000000-f6e1855e0d47dfee9cd4 |
| Source of Spectrum |
B-43-1726-6 |
| Wiley ID |
1349746 |
![2,7-Dioxabicyclo[3.2.1]octan-3-one, 6-(acetyloxy)-8-[1-[(1,3,3-trimethylcyclohexyl)methylene]-2-propenyl]-, [1.alpha.,5.alpha.,6.alpha.,8S*[Z(R*)]]-(+)-](/api/spectrum/APPLBGXwslw/structure.png?h=300&w=458 "2,7-Dioxabicyclo[3.2.1]octan-3-one, 6-(acetyloxy)-8-[1-[(1,3,3-trimethylcyclohexyl)methylene]-2-propenyl]-, [1.alpha.,5.alpha.,6.alpha.,8S*[Z(R*)]]-(+)-")
