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DEMETHYLLAPPACONITINE
SpectraBase Compound ID Fzc7D03hr68
InChI InChI=1S/C31H42N2O8/c1-5-33-15-28(41-27(36)17-8-6-7-9-20(17)32-16(2)34)11-10-24(35)30-22(28)13-19(25(30)33)29(37)14-21(39-3)18-12-23(30)31(29,38)26(18)40-4/h6-9,18-19,21-26,35,37-38H,5,10-15H2,1-4H3,(H,32,34)/t18-,19+,21+,22-,23?,24+,25?,26+,28-,29+,30+,31+/m1/s1
InChIKey AQKSTZMIVRWLML-KGTSGILMSA-N
Mol Weight 570.7 g/mol
Molecular Formula C31H42N2O8
Exact Mass 570.294116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2ju2FQ790ef
Name DEMETHYLLAPPACONITINE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H42N2O8
InChI InChI=1S/C31H42N2O8/c1-5-33-15-28(41-27(36)17-8-6-7-9-20(17)32-16(2)34)11-10-24(35)30-22(28)13-19(25(30)33)29(37)14-21(39-3)18-12-23(30)31(29,38)26(18)40-4/h6-9,18-19,21-26,35,37-38H,5,10-15H2,1-4H3,(H,32,34)/t18-,19+,21+,22-,23?,24+,25?,26+,28-,29+,30+,31+/m1/s1
InChIKey AQKSTZMIVRWLML-KGTSGILMSA-N
Literature Reference Author A.ULUBELEN,A.H.MERICLI,F.MERICLI,F.YILMAZ
Literature Reference Citation PHYTOCHEM.,41,957(1996)
Literature Reference DOI 10.1016/0031-9422(95)00670-2
Molecular Weight 570.683 g/mol
Solvent Unknown
Source File Reference UWLU4171