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MITHACONITINE
SpectraBase Compound ID 6DpZ0g8UjSi
InChI InChI=1S/C32H43NO8/c1-6-33-15-30(16-37-2)20(34)13-22(39-4)32-19-14-31(36)21(38-3)12-18(24(27(32)33)25(40-5)26(30)32)23(19)28(31)41-29(35)17-10-8-7-9-11-17/h7-12,19-28,34,36H,6,13-16H2,1-5H3/t19?,20-,21+,22+,23?,24+,25+,26?,27?,28-,30+,31+,32+/m1/s1
InChIKey CCBSMPVKKCPBNN-YSFLFFMUSA-N
Mol Weight 569.7 g/mol
Molecular Formula C32H43NO8
Exact Mass 569.298867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnDL9Zbi1ed
Name MITHACONITINE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H43NO8
InChI InChI=1S/C32H43NO8/c1-6-33-15-30(16-37-2)20(34)13-22(39-4)32-19-14-31(36)21(38-3)12-18(24(27(32)33)25(40-5)26(30)32)23(19)28(31)41-29(35)17-10-8-7-9-11-17/h7-12,19-28,34,36H,6,13-16H2,1-5H3/t19?,20-,21+,22+,23?,24+,25+,26?,27?,28-,30+,31+,32+/m1/s1
InChIKey CCBSMPVKKCPBNN-YSFLFFMUSA-N
Literature Reference Author S.W.PELLETIER,N.V.MODY,R.S.SAWHNEY,J.BHATTACHARYYA
Literature Reference Citation HETEROCYCLES,7,327(1977)
Literature Reference DOI 10.3987/S-1977-01-0327
Molecular Weight 569.695 g/mol
Solvent CDCl3
Source File Reference UWRK2453