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(2S,3S,4S,6E,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2,12-diethyl-3-hydroxy-9-keto-4,6,8,10-tetramethyl-trideca-6,12-dienethioic acid S-tert-butyl ester

View entire compound with spectra: 2 MS (GC)

(2S,3S,4S,6E,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2,12-diethyl-3-hydroxy-9-keto-4,6,8,10-tetramethyl-trideca-6,12-dienethioic acid S-tert-butyl ester
SpectraBase Compound ID LMcBSXnlwXF
InChI InChI=1S/C31H58O4SSi/c1-16-21(4)28(35-37(14,15)31(11,12)13)24(7)26(32)22(5)18-20(3)19-23(6)27(33)25(17-2)29(34)36-30(8,9)10/h18,22-25,27-28,33H,4,16-17,19H2,1-3,5-15H3/b20-18+/t22-,23+,24-,25+,27+,28-/m1/s1
InChIKey DVXQRISPZLZJHJ-COZCUYRJSA-N
Mol Weight 554.9 g/mol
Molecular Formula C31H58O4SSi
Exact Mass 554.382508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qoDov8Rli2
Name (2S,3S,4S,6E,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2,12-diethyl-3-hydroxy-9-keto-4,6,8,10-tetramethyl-trideca-6,12-dienethioic acid S-tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H58O4SSi
InChI InChI=1S/C31H58O4SSi/c1-16-21(4)28(35-37(14,15)31(11,12)13)24(7)26(32)22(5)18-20(3)19-23(6)27(33)25(17-2)29(34)36-30(8,9)10/h18,22-25,27-28,33H,4,16-17,19H2,1-3,5-15H3/b20-18+/t22-,23+,24-,25+,27+,28-/m1/s1
InChIKey DVXQRISPZLZJHJ-COZCUYRJSA-N
Molecular Weight 554.946 g/mol
SMILES O[C@]([C@@](C(SC(C)(C)C)=O)(CC)[H])([C@](C\C(=C\[C@](C([C@]([C@](O[Si](C(C)(C)C)(C)C)(C(=C)CC)[H])(C)[H])=O)(C)[H])C)(C)[H])[H]
SPLASH splash10-0002-0940200000-4c694f5514eb2a89094c
Source of Spectrum J-60-3298-35
Synonyms (2R,3R,4S,6E,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2,12-diethyl-3-hydroxy-9-keto-4,6,8,10-tetramethyl-trideca-6,12-dienethioic acid S-tert-butyl ester (E,2R,3R,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylene-9-oxo-6-tetradecenethioic acid S-tert-butyl ester S-tert-butyl (E,2R,3R,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylene-9-oxo-tetradec-6-enethioate S-tert-butyl (E,2R,3R,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylidene-9-oxotetradec-6-enethioate (E,2S,3S,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylene-9-oxo-6-tetradecenethioic acid S-tert-butyl ester S-tert-butyl (E,2R,3R,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-4,6,8,10-tetramethyl-12-methylidene-3-oxidanyl-9-oxidanylidene-tetradec-6-enethioate S-tert-butyl (E,2S,3S,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylidene-9-oxotetradec-6-enethioate S-tert-butyl (E,2S,3S,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-3-hydroxy-4,6,8,10-tetramethyl-12-methylene-9-oxo-tetradec-6-enethioate S-tert-butyl (E,2S,3S,4S,8R,10S,11S)-11-[tert-butyl(dimethyl)silyl]oxy-2-ethyl-4,6,8,10-tetramethyl-12-methylidene-3-oxidanyl-9-oxidanylidene-tetradec-6-enethioate
Wiley ID 1406210