| SpectraBase Spectrum ID |
3V95MfWubi6 |
| Name |
(3R,4R,5S,9S,10S,11S)-3-S-(1,2-Dimercaptoethyl)-morelian-1,7-dione 1-ethylenedithioketal |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H30OS4 |
| InChI |
InChI=1S/C19H30OS4/c1-11-12-9-13(20)17(2,3)16-14(11)19(23-7-8-24-19)10-18(4,15(12)16)22-6-5-21/h11-12,14-16,21H,5-10H2,1-4H3/t11-,12-,14+,15+,16+,18+/m0/s1 |
| InChIKey |
CNVKPEWTJVHEKC-HADXRLKASA-N |
| Instrument Name |
Hewlett-Packard 5989A or Varian Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030354e |
| Molecular Weight |
402.688 g/mol |
| Optical Rotation |
[a]D = +60 (c = 1.45) |
| Reported Formula |
C19H30OS4 |
| SMILES |
SCCS[C@@]1(CC2([C@]3([C@@]4([C@]1([C@@](CC(C4(C)C)=O)([C@@]3(C)[H])[H])[H])[H])[H])SCCS2)C |
| SPLASH |
splash10-0a4i-0549300000-b4cabd6a1c9dd2795ace |
| Source of Spectrum |
G4-67-192-7 |
| Wiley ID |
1881661 |
