| SpectraBase Spectrum ID |
DEaIqa5ZA5n |
| Name |
(1S,2R,3S,4S,5R,6S)-2,3,4-Triacetoxy-5-(Z-2'-cyano-2'-tert-butylmercaptoethenyl)amino)-7-oxabicyclo[4.1.0]heptane |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H26N2O7S |
| InChI |
InChI=1S/C19H26N2O7S/c1-5-6-7-29-13(8-20)9-21-14-15(25-10(2)22)17(26-11(3)23)19(27-12(4)24)18-16(14)28-18/h9,14-19,21H,5-7H2,1-4H3/b13-9-/t14-,15-,16-,17-,18-,19-/m0/s1 |
| InChIKey |
CBHXQBDSJNKLAB-ZGYGUTEZSA-N |
| Molecular Weight |
426.484 g/mol |
| SMILES |
N([C@@]1([C@]2([C@](O2)([C@]([C@]([C@]1(OC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])[H])[H])\C=C\(C#N)SCCCC |
| SPLASH |
splash10-002f-9008000000-b7f4678fdc2edd53d6ee |
| Source of Spectrum |
QC-1-412-20 |
| Wiley ID |
882801 |
![(1S,2R,3S,4S,5R,6S)-2,3,4-Triacetoxy-5-(Z-2'-cyano-2'-tert-butylmercaptoethenyl)amino)-7-oxabicyclo[4.1.0]heptane](/api/spectrum/DEaIqa5ZA5n/structure.png?h=300&w=458 "(1S,2R,3S,4S,5R,6S)-2,3,4-Triacetoxy-5-(Z-2'-cyano-2'-tert-butylmercaptoethenyl)amino)-7-oxabicyclo[4.1.0]heptane")
