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Anhydro-aconitine
SpectraBase Compound ID HUMP08gtdWf
InChI InChI=1S/C34H45NO10/c1-7-35-16-31(17-40-3)14-13-21(41-4)33-20-15-32(39)28(44-30(38)19-11-9-8-10-12-19)22(20)34(45-18(2)36,27(37)29(32)43-6)23(26(33)35)24(42-5)25(31)33/h8-14,20-29,37,39H,7,15-17H2,1-6H3/t20?,21-,22?,23-,24-,25?,26?,27?,28+,29-,31-,32+,33-,34+/m0/s1
InChIKey ODNSFUMREKLILI-FPEIJSOFSA-N
Mol Weight 627.7 g/mol
Molecular Formula C34H45NO10
Exact Mass 627.304347 g/mol
Enantiomer InChIKey ODNSFUMREKLILI-ZHHFTASGSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Carbon-13 nuclear magnetic resonance: aconitine-type diterpenoid alkaloids from Aconitum and Delphinium species Journal of the American Chemical Society 1976

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