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(-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-6-ALPHA,8-BETA,15-ALPHA-TRIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
SpectraBase Compound ID J3U40nXuLXw
InChI InChI=1S/C31H43NO8/c1-5-32-14-29(15-37-2)12-11-19(38-3)30-18-13-17-23(40-28(35)16-9-7-6-8-10-16)20(18)31(36,27(34)24(17)39-4)21(26(30)32)22(33)25(29)30/h6-10,17-27,33-34,36H,5,11-15H2,1-4H3/t17-,18+,19-,20+,21-,22-,23-,24+,25+,26+,27-,29-,30-,31+/m0/s1
InChIKey ZFDOMABJGIHODE-YKSNUIRFSA-N
Mol Weight 557.7 g/mol
Molecular Formula C31H43NO8
Exact Mass 557.298867 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ib4BiJkFIUv
Name (-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-6-ALPHA,8-BETA,15-ALPHA-TRIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO8
InChI InChI=1S/C31H43NO8/c1-5-32-14-29(15-37-2)12-11-19(38-3)30-18-13-17-23(40-28(35)16-9-7-6-8-10-16)20(18)31(36,27(34)24(17)39-4)21(26(30)32)22(33)25(29)30/h6-10,17-27,33-34,36H,5,11-15H2,1-4H3/t17-,18+,19-,20+,21-,22-,23-,24+,25+,26+,27-,29-,30-,31+/m0/s1
InChIKey ZFDOMABJGIHODE-YKSNUIRFSA-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 557.684 g/mol
Sample ID 41172
Solvent ACETONE-D6