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3[BETA]-ACETOXYTARAXASTER-20-EN-30-OIC-ACID
SpectraBase Compound ID KmdrPp0oebp
InChI InChI=1S/C32H50O4/c1-19-21(27(34)35)11-14-29(5)17-18-31(7)22(26(19)29)9-10-24-30(6)15-13-25(36-20(2)33)28(3,4)23(30)12-16-32(24,31)8/h11,19,22-26H,9-10,12-18H2,1-8H3,(H,34,35)/t19-,22-,23+,24-,25+,26-,29-,30+,31-,32-/m1/s1
InChIKey OGLOAGGXOJTIJG-KRJZKMEJSA-N
Mol Weight 498.7 g/mol
Molecular Formula C32H50O4
Exact Mass 498.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jo3W62YrkqG
Name 3[BETA]-ACETOXYTARAXASTER-20-EN-30-OIC-ACID
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H50O4
InChI InChI=1S/C32H50O4/c1-19-21(27(34)35)11-14-29(5)17-18-31(7)22(26(19)29)9-10-24-30(6)15-13-25(36-20(2)33)28(3,4)23(30)12-16-32(24,31)8/h11,19,22-26H,9-10,12-18H2,1-8H3,(H,34,35)/t19-,22-,23+,24-,25+,26-,29-,30+,31-,32-/m1/s1
InChIKey OGLOAGGXOJTIJG-KRJZKMEJSA-N
Literature Reference Author J.TRIANA,M.LOPEZ,F.J.PEREZ,J.G.PLATAS,F.ESTEVEZ,J.F.LEON,J.C .HERNANDEZ,I.BROUARD
Literature Reference Citation FITOTERAPIA,80,437(2009)
Literature Reference DOI 10.1016/j.fitote.2009.06.001
Molecular Weight 498.747 g/mol
Solvent CDCl3
Source File Reference UWMB1005