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LAPPACONITINE
SpectraBase Compound ID 8gWBTwgP4cV
InChI InChI=1S/C32H44N2O8/c1-6-34-16-29(42-28(36)18-9-7-8-10-21(18)33-17(2)35)12-11-25(40-4)31-23(29)14-20(26(31)34)30(37)15-22(39-3)19-13-24(31)32(30,38)27(19)41-5/h7-10,19-20,22-27,37-38H,6,11-16H2,1-5H3,(H,33,35)/t19-,20?,22+,23-,24+,25+,26?,27+,29-,30+,31+,32+/m1/s1
InChIKey NWBWCXBPKTTZNQ-HZSJEBRYSA-N
Mol Weight 584.7 g/mol
Molecular Formula C32H44N2O8
Exact Mass 584.309766 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPchCnXkMRs
Name LAPPACONITINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H44N2O8
InChI InChI=1S/C32H44N2O8/c1-6-34-16-29(42-28(36)18-9-7-8-10-21(18)33-17(2)35)12-11-25(40-4)31-23(29)14-20(26(31)34)30(37)15-22(39-3)19-13-24(31)32(30,38)27(19)41-5/h7-10,19-20,22-27,37-38H,6,11-16H2,1-5H3,(H,33,35)/t19-,20?,22+,23-,24+,25+,26?,27+,29-,30+,31+,32+/m1/s1
InChIKey NWBWCXBPKTTZNQ-HZSJEBRYSA-N
Literature Reference Author Y.BAI,H.K.DESAI,S.W.PELLETIER
Literature Reference Citation J.NAT.PROD.,58,929(1995)
Literature Reference DOI 10.1021/np50120a018
Molecular Weight 584.710 g/mol
Solvent CDCl3
Source File Reference UWVP6500