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AUSTRALIN_A
SpectraBase Compound ID BlaAwstq3pv
InChI InChI=1S/C22H36O6/c1-12(2)14-7-10-22(6,28-13(3)23)18-15(24)11-21(5,26)16-8-9-20(4,25)19(27-16)17(14)18/h12,14,16-19,25-26H,7-11H2,1-6H3/t14-,16-,17-,18-,19-,20-,21-,22-/m1/s1
InChIKey CKMZLJUYJFHCKF-MOERMCBMSA-N
Mol Weight 396.5 g/mol
Molecular Formula C22H36O6
Exact Mass 396.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgSWBmqmoR2
Name AUSTRALIN_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O6
InChI InChI=1S/C22H36O6/c1-12(2)14-7-10-22(6,28-13(3)23)18-15(24)11-21(5,26)16-8-9-20(4,25)19(27-16)17(14)18/h12,14,16-19,25-26H,7-11H2,1-6H3/t14-,16-,17-,18-,19-,20-,21-,22-/m1/s1
InChIKey CKMZLJUYJFHCKF-MOERMCBMSA-N
Literature Reference Author A.F.AHMED,M.H.WU,G.H.WANG,Y.C.WU,J.H.SHEU
Literature Reference Citation J.NAT.PROD.,68,1051(2005)
Literature Reference DOI 10.1021/np0500732
Molecular Weight 396.524 g/mol
Solvent CDCl3
Source File Reference UWMZ12101