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(-)-(A-B)-8-BETA-ACETOXY-14-ALPHA-BENZOYLOXY-N-ETHYL-15-ALPHA-HYDROXY-1-ALPHA,6-ALPHA,16-BETA,18-TETRAMETHOXYACONITANE
SpectraBase Compound ID 8LCvKwQ3djv
InChI InChI=1S/C34H47NO9/c1-7-35-16-32(17-39-3)14-13-22(40-4)33-21-15-20-25(43-31(38)19-11-9-8-10-12-19)23(21)34(44-18(2)36,30(37)26(20)41-5)24(29(33)35)27(42-6)28(32)33/h8-12,20-30,37H,7,13-17H2,1-6H3/t20-,21+,22-,23+,24-,25-,26+,27-,28+,29+,30-,32-,33-,34+/m0/s1
InChIKey QKWSDRKVSSNPCU-OORMJEGNSA-N
Mol Weight 613.7 g/mol
Molecular Formula C34H47NO9
Exact Mass 613.325082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JGc6gfrhbR8
Name (-)-(A-B)-8-BETA-ACETOXY-14-ALPHA-BENZOYLOXY-N-ETHYL-15-ALPHA-HYDROXY-1-ALPHA,6-ALPHA,16-BETA,18-TETRAMETHOXYACONITANE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H47NO9
InChI InChI=1S/C34H47NO9/c1-7-35-16-32(17-39-3)14-13-22(40-4)33-21-15-20-25(43-31(38)19-11-9-8-10-12-19)23(21)34(44-18(2)36,30(37)26(20)41-5)24(29(33)35)27(42-6)28(32)33/h8-12,20-30,37H,7,13-17H2,1-6H3/t20-,21+,22-,23+,24-,25-,26+,27-,28+,29+,30-,32-,33-,34+/m0/s1
InChIKey QKWSDRKVSSNPCU-OORMJEGNSA-N
Literature Reference Author B.JIANG,S.LIN,C.ZHU,S.WANG,Y.WANG,M.CHEN,J.ZHANG,J.HU,N.CHEN ,Y.YANG,J.SHI
Literature Reference Citation J.NAT.PROD.,75,1145(2012)
Literature Reference DOI 10.1021/np300225t
Molecular Weight 613.748 g/mol
Sample ID 41177
Solvent ACETONE-D6