| SpectraBase Spectrum ID |
1OKfIjcWWW |
| Name |
(5R,5aS,10aR,10bR)-5-Acetylthiooctahydrooxepino[3,4-d]isoxazol[b-1,2]pyrrolo-1(3H)-one |
| Alternate Name(s) |
(5RS,5aRS,10aSR,10bSR)-5-Acetylthiooctahydrooxepino[3,4-d]pyrrolo[1,2-b]isoxazol-1(3H)-one
S-[(5R,5aS,10aR,10bR)-1-oxodecahydrooxepino[3,4-d]pyrrolo[1,2-b]isoxazol-5-yl]ethanethioate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H17NO4S |
| InChI |
InChI=1S/C12H17NO4S/c1-7(14)18-9-4-6-16-12(15)10-8-3-2-5-13(8)17-11(9)10/h8-11H,2-6H2,1H3/t8-,9-,10-,11-/m1/s1 |
| InChIKey |
WPKHVLVZBKVKJF-GWOFURMSSA-N |
| Molecular Weight |
271.331 g/mol |
| SMILES |
[C@@]12([C@@]([C@]3(CCCN3O2)[H])(C(OCC[C@]1(SC(=O)C)[H])=O)[H])[H] |
| SPLASH |
splash10-000l-9100000000-42b842553fe6f10bb1b2 |
| Source of Spectrum |
F-53-16813-16 |
| Wiley ID |
804800 |
![(5R,5aS,10aR,10bR)-5-Acetylthiooctahydrooxepino[3,4-d]isoxazol[b-1,2]pyrrolo-1(3H)-one](/api/spectrum/1OKfIjcWWW/structure.png?h=300&w=458 "(5R,5aS,10aR,10bR)-5-Acetylthiooctahydrooxepino[3,4-d]isoxazol[b-1,2]pyrrolo-1(3H)-one")
