| SpectraBase Spectrum ID |
5lJbeNtMY0o |
| Name |
(1S,2S,4S,5R,6R,7R)-5,6-Diacetoxy-8-(E,Z-2'-cyano-2'-tert-butylmercaptoethenyl)-8-aza-3-oxatricyclo[5.1.0.0(2,4)]octane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22N2O5S |
| InChI |
InChI=1S/C17H22N2O5S/c1-8(20)22-13-11-12(14-16(24-14)15(13)23-9(2)21)19(11)7-10(6-18)25-17(3,4)5/h7,11-16H,1-5H3/b10-7+/t11-,12+,13-,14+,15-,16+,19?/m1/s1 |
| InChIKey |
SIBHXGIETDMWHZ-ZHLYUBBRSA-N |
| Molecular Weight |
366.432 g/mol |
| SMILES |
[C@@]12(N([C@]1([C@]([C@]([C@@]1([C@]2(O1)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])\C=C/(C#N)SC(C)(C)C)[H] |
| SPLASH |
splash10-0006-9001000000-efd217bf4cd752efa85a |
| Source of Spectrum |
QC-1-411-15 |
| Synonyms |
(1S,2S,4S,5R,6R,7R)-5-(acetyloxy)-8-[(E)-2-(tert-butylsulfanyl)-2-cyanoethenyl]-3-oxa-8-azatricyclo[5.1.0.0(2,4)]oct-6-yl acetate |
| Wiley ID |
882804 |
![(1S,2S,4S,5R,6R,7R)-5,6-Diacetoxy-8-(E,Z-2'-cyano-2'-tert-butylmercaptoethenyl)-8-aza-3-oxatricyclo[5.1.0.0(2,4)]octane](/api/spectrum/5lJbeNtMY0o/structure.png?h=300&w=458 "(1S,2S,4S,5R,6R,7R)-5,6-Diacetoxy-8-(E,Z-2'-cyano-2'-tert-butylmercaptoethenyl)-8-aza-3-oxatricyclo[5.1.0.0(2,4)]octane")
