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SCULPONIN_I;11-BETA,15-BETA,19-BETA-TRIHYDROXY-6,19;6,20-DIEPOXY-6,7-SECO-ENT-KAUR-16-EN-1-BETA,7-OLIDE
SpectraBase Compound ID AMYgyH62NaC
InChI InChI=1S/C20H26O7/c1-8-9-5-10(21)12-19(6-9,14(8)22)17(24)26-11-3-4-18(2)13-15(27-16(18)23)25-7-20(11,12)13/h9-16,21-23H,1,3-7H2,2H3/t9-,10-,11+,12-,13-,14-,15+,16-,18-,19+,20+/m1/s1
InChIKey LFLODSREXVMKOC-VRVURSTQSA-N
Mol Weight 378.42 g/mol
Molecular Formula C20H26O7
Exact Mass 378.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DfvXfGPulMI
Name SCULPONIN_I;11-BETA,15-BETA,19-BETA-TRIHYDROXY-6,19;6,20-DIEPOXY-6,7-SECO-ENT-KAUR-16-EN-1-BETA,7-OLIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O7
InChI InChI=1S/C20H26O7/c1-8-9-5-10(21)12-19(6-9,14(8)22)17(24)26-11-3-4-18(2)13-15(27-16(18)23)25-7-20(11,12)13/h9-16,21-23H,1,3-7H2,2H3/t9-,10-,11+,12-,13-,14-,15+,16-,18-,19+,20+/m1/s1
InChIKey LFLODSREXVMKOC-VRVURSTQSA-N
Literature Reference Author L.M.LI,G.Y.LI,J.X.PU,W.L.PU,W.L.XIAO,L.S.DING,H.D.SUN
Literature Reference Citation J.NAT.PROD.,72,1851(2009)
Literature Reference DOI 10.1021/np900406c
Molecular Weight 378.422 g/mol
Sample ID 33736
Solvent C5D5N