| SpectraBase Spectrum ID |
4hZtIWXx4a |
| Name |
[(1S,2R,4aR,5R,6S,7S,8aR)-7-acetoxy-1-hydroxy-1,5,6,8a-tetramethyl-5-[2-(5-oxo-2H-furan-4-yl)ethyl]decalin-2-yl] acetate |
| Appearance |
Colorless block crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H36O7 |
| InChI |
InChI=1S/C24H36O7/c1-14-18(30-15(2)25)13-23(5)19(7-8-20(24(23,6)28)31-16(3)26)22(14,4)11-9-17-10-12-29-21(17)27/h10,14,18-20,28H,7-9,11-13H2,1-6H3/t14-,18+,19-,20-,22+,23-,24-/m1/s1 |
| InChIKey |
VAGLCJLVICMOSW-OIXPENTDSA-N |
| Ionization Type |
EI |
| Molecular Weight |
436.545 g/mol |
| Optical Rotation |
[a]D15.2 = -74.8 (c = 0.15, MeOH) |
| Reported Formula |
C24H36O7 |
| SMILES |
O[C@]1([C@]2([C@](CC[C@]1(OC(C)=O)[H])([C@]([C@@]([C@](C2)(OC(=O)C)[H])(C)[H])(CCC=1C(OCC1)=O)C)[H])C)C |
| SPLASH |
splash10-05mo-6294000000-e8d45959c49779ba5fcd |
| Source of Spectrum |
CN103923076B |
| Wiley ID |
1850745 |
![[(1S,2R,4aR,5R,6S,7S,8aR)-7-acetoxy-1-hydroxy-1,5,6,8a-tetramethyl-5-[2-(5-oxo-2H-furan-4-yl)ethyl]decalin-2-yl] acetate](/api/spectrum/4hZtIWXx4a/structure.png?h=300&w=458 "[(1S,2R,4aR,5R,6S,7S,8aR)-7-acetoxy-1-hydroxy-1,5,6,8a-tetramethyl-5-[2-(5-oxo-2H-furan-4-yl)ethyl]decalin-2-yl] acetate")
