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(E)-3-phenylacrylic acid [(2S,4R,5R,5aS,6S,8S,9aR,10aS)-2,4,5,6-tetraacetoxy-10a-(1-hydroxy-1-methyl-ethyl)-3,5a-dimethyl-9-methylene-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[g]azulen-8-yl] ester

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

(E)-3-phenylacrylic acid [(2S,4R,5R,5aS,6S,8S,9aR,10aS)-2,4,5,6-tetraacetoxy-10a-(1-hydroxy-1-methyl-ethyl)-3,5a-dimethyl-9-methylene-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[g]azulen-8-yl] ester
SpectraBase Compound ID 7fm5VYnXYhG
InChI InChI=1S/C37H46O11/c1-20-27-18-37(35(7,8)43)19-29(44-22(3)38)21(2)32(37)33(46-24(5)40)34(47-25(6)41)36(27,9)30(45-23(4)39)17-28(20)48-31(42)16-15-26-13-11-10-12-14-26/h10-16,27-30,33-34,43H,1,17-19H2,2-9H3/b16-15+/t27-,28+,29+,30+,33-,34+,36+,37+/m1/s1
InChIKey FGTMAWRUPJWDFN-NRHDFMLESA-N
Mol Weight 666.8 g/mol
Molecular Formula C37H46O11
Exact Mass 666.304012 g/mol
Enantiomer InChIKey FGTMAWRUPJWDFN-IXWQJICUSA-N

View Spectrum of (E)-3-phenylacrylic acid [(2S,4R,5R,5aS,6S,8S,9aR,10aS)-2,4,5,6-tetraacetoxy-10a-(1-hydroxy-1-methyl-ethyl)-3,5a-dimethyl-9-methylene-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[g]azulen-8-yl] ester

MS (GC) Spectrum
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Source of Spectrum F-51-5978-5

View Spectrum of (E)-3-phenylacrylic acid [(2S,4R,5R,5aS,6S,8S,9aR,10aS)-2,4,5,6-tetraacetoxy-10a-(1-hydroxy-1-methyl-ethyl)-3,5a-dimethyl-9-methylene-2,4,5,6,7,8,9a,10-octahydro-1H-benzo[g]azulen-8-yl] ester

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • Taxuspine J
Title Journal or Book Year
10.1139/cjc-79-9-1381 "" ""
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