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(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid

Compound with spectra: 1 NMR, and 1 MS (GC)

(2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid
SpectraBase Compound ID HaZAhOP9Cqu
InChI InChI=1S/C22H42O5/c1-9-13(3)11-15(5)19(23)17(7)22(26)27-20(18(8)21(24)25)16(6)12-14(4)10-2/h13-20,23H,9-12H2,1-8H3,(H,24,25)/t13-,14-,15-,16-,17+,18+,19+,20+/m1/s1
InChIKey ZQEUMOKDJCSNHB-IHRHECOVSA-N
Mol Weight 386.6 g/mol
Molecular Formula C22H42O5
Exact Mass 386.303224 g/mol
Enantiomer InChIKey ZQEUMOKDJCSNHB-ABFWNZAKSA-N

View Spectrum of (2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid

13C NMR Spectrum
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View Spectrum of (2S,3S,4R,6R)-2,4,6-trimethyl-3-[(2S,3S,4R,6R)-2,4,6-trimethyl-3-oxidanyl-octanoyl]oxy-octanoic acid

MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-59-3358-1
  • (2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyl-octanoyl]oxy-2,4,6-trimethyl-caprylic acid
  • (2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyloctanoyl]oxy-2,4,6-trimethyloctanoic acid
  • (2S,3S,4R,6R)-3-[(2S,3S,4R,6R)-3-hydroxy-2,4,6-trimethyl-1-oxooctoxy]-2,4,6-trimethyloctanoic acid
8,9-DIHYDRO-10-DEOXY-METHYNOLIDE
Butanoic acid, 4-(acetyloxy)-3-hydroxy-2-methyl-, 8-(acetyloxy)-1-[2-(acetyloxy)-1-methylethyl]-2,4-dimethyloctyl ester
10-DEOXY-METHYNOLIDE
(2S,3R,4R)-2-Methyl-4-((rs)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl isobutyrate
(rs)-(2S,3R,4R)-2-Methyl-4-(5-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
(rs)-(2S,3R,4R)-4-Butyl-2-methyl-5-oxotetrahydrofuran-3-yl 2-methylbutanoate
(2S,3R,4R)-2-Methyl-4-((rs)-4-methylhexyl)-5-oxotetrahydrofuran-3-yl 2-ethylbutanoate
(2S,3R,4R)-4-Isopentyl-2-methyl-5-oxotetrahydrofuran-3-yl 2-ethylbutanoate
BONACTIN
Arabinonic acid, 2,4-dideoxy-2,4-dimethyl-5-C-phenyl-, .delta.-lactone, (5S*)-
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