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THEOPEDERIN-A,MAJOR-ISOMER
SpectraBase Compound ID wxPvfJR5Ah
InChI InChI=1S/C27H45NO10/c1-14-12-27(33-7,38-16(3)15(14)2)22(30)24(31)28-25-21-20(34-13-35-25)23(32-6)26(4,5)18(37-21)11-17-9-8-10-19(29)36-17/h15-23,25,29-30H,1,8-13H2,2-7H3,(H,28,31)/t15-,16-,17+,18-,19?,20+,21+,22-,23-,25+,27-/m0/s1
InChIKey KRUGJXMIOXHJEU-RDRGVGONSA-N
Mol Weight 543.7 g/mol
Molecular Formula C27H45NO10
Exact Mass 543.304347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AmbytHS5TgF
Name THEOPEDERIN-A,MAJOR-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H45NO10
InChI InChI=1S/C27H45NO10/c1-14-12-27(33-7,38-16(3)15(14)2)22(30)24(31)28-25-21-20(34-13-35-25)23(32-6)26(4,5)18(37-21)11-17-9-8-10-19(29)36-17/h15-23,25,29-30H,1,8-13H2,2-7H3,(H,28,31)/t15-,16-,17+,18-,19?,20+,21+,22-,23-,25+,27-/m0/s1
InChIKey KRUGJXMIOXHJEU-RDRGVGONSA-N
Literature Reference Author N.FUSETANI,T.SUGAWARA,S.MATSUNAGA
Literature Reference Citation J.ORG.CHEM.,57,3828(1992)
Literature Reference DOI 10.1021/jo00040a021
Molecular Weight 543.655 g/mol
Solvent CDCl3
Source File Reference UWCS781