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#8;(5-Z)-5-[(2-S,2A-R,6-S,7A-S,7B-S,8-R,9-S)-7B-(1-E)-1-(3'-OXO-1'-BUTENYL)-HEXAHYDRO-9-METHYL-4-H-2,2,6-(EPOXY-[1]-PROPANYL-[3]-YLIDENE)-FURO-[2,3,4-GH]-PYROL
SpectraBase Compound ID KzhGSAlyjjb
InChI InChI=1S/C22H25NO6/c1-10(24)5-7-21-14-6-8-23(21)13-9-15(21)28-22(14)16(13)11(2)18(29-22)19-17(26-4)12(3)20(25)27-19/h5,7,11,13-16H,6,8-9H2,1-4H3/b7-5+,19-18-/t11-,13-,14+,15+,16+,21-,22+/m0/s1
InChIKey DTOWKURNTDNPQT-UNQFTLNWSA-N
Mol Weight 399.44 g/mol
Molecular Formula C22H25NO6
Exact Mass 399.168188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LwixPgb9lTq
Name #8;(5-Z)-5-[(2-S,2A-R,6-S,7A-S,7B-S,8-R,9-S)-7B-(1-E)-1-(3'-OXO-1'-BUTENYL)-HEXAHYDRO-9-METHYL-4-H-2,2,6-(EPOXY-[1]-PROPANYL-[3]-YLIDENE)-FURO-[2,3,4-GH]-PYROL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25NO6
InChI InChI=1S/C22H25NO6/c1-10(24)5-7-21-14-6-8-23(21)13-9-15(21)28-22(14)16(13)11(2)18(29-22)19-17(26-4)12(3)20(25)27-19/h5,7,11,13-16H,6,8-9H2,1-4H3/b7-5+,19-18-/t11-,13-,14+,15+,16+,21-,22+/m0/s1
InChIKey DTOWKURNTDNPQT-UNQFTLNWSA-N
Literature Reference Author M.C.BAIRD,S.G.PYNE,A.T.UNG,W.LIE,T.SASTRARUJI,A.JATISATIENR, C.JATISATIENR,S.DHEE
Literature Reference Citation J.NAT.PROD.,72,679(2009)
Literature Reference DOI 10.1021/np800806b
Molecular Weight 399.444 g/mol
Sample ID 32429
Solvent CDCl3