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LEOSIBIRONE_A;3-ALPHA-ACETOXY-15,16-EPOXY-6-BETA,9-ALPHA-DIHYDROXYLABDA-13-(16),14-DIEN-7-ONE
SpectraBase Compound ID Cr9fedi58CN
InChI InChI=1S/C22H32O6/c1-13-17(24)18(25)19-20(3,4)16(28-14(2)23)7-9-21(19,5)22(13,26)10-6-15-8-11-27-12-15/h8,11-13,16,18-19,25-26H,6-7,9-10H2,1-5H3/t13-,16-,18-,19+,21+,22-/m1/s1
InChIKey RWOAGXCXGZWXLF-VCOBGZKZSA-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 4mNrgDFpXrx
Name LEOSIBIRONE_A;3-ALPHA-ACETOXY-15,16-EPOXY-6-BETA,9-ALPHA-DIHYDROXYLABDA-13-(16),14-DIEN-7-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O6
InChI InChI=1S/C22H32O6/c1-13-17(24)18(25)19-20(3,4)16(28-14(2)23)7-9-21(19,5)22(13,26)10-6-15-8-11-27-12-15/h8,11-13,16,18-19,25-26H,6-7,9-10H2,1-5H3/t13-,16-,18-,19+,21+,22-/m1/s1
InChIKey RWOAGXCXGZWXLF-VCOBGZKZSA-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 37354
Solvent ACETONE-D6