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13-EPI-PRELEOSIBIRONE_A;3-ALPHA-ACETOXY-9-ALPHA,13-R;15,16-DIEPOXY-6-BETA-HYDROXYLABD-14-EN-7-ONE
SpectraBase Compound ID D0lHOg8hOi5
InChI InChI=1S/C22H32O6/c1-13-16(24)17(25)18-19(3,4)15(27-14(2)23)6-7-20(18,5)22(13)9-8-21(28-22)10-11-26-12-21/h10-11,13,15,17-18,25H,6-9,12H2,1-5H3/t13-,15-,17-,18+,20+,21-,22-/m1/s1
InChIKey PHNDFJBMMYOJPB-IYANZZNRSA-N
Mol Weight 392.5 g/mol
Molecular Formula C22H32O6
Exact Mass 392.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4GRgzJa0sgf
Name 13-EPI-PRELEOSIBIRONE_A;3-ALPHA-ACETOXY-9-ALPHA,13-R;15,16-DIEPOXY-6-BETA-HYDROXYLABD-14-EN-7-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-13-16(24)17(25)18-19(3,4)15(27-14(2)23)6-7-20(18,5)22(13)9-8-21(28-22)10-11-26-12-21/h10-11,13,15,17-18,25H,6-9,12H2,1-5H3/t13-,15-,17-,18+,20+,21-,22-/m1/s1
InChIKey PHNDFJBMMYOJPB-IYANZZNRSA-N
Literature Reference Author H.WU,F.R.FRONCZEK,D.FERREIRA,C.L.BURANDT,J.K.ZJAWIONY
Literature Reference Citation J.NAT.PROD.,74,831(2011)
Literature Reference DOI 10.1021/np100956k
Molecular Weight 392.492 g/mol
Sample ID 37352
Solvent ACETONE-D6