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(-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-8-BETA,13-BETA,15-ALPHA-TRIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
SpectraBase Compound ID 15P1Hk3A3QP
InChI InChI=1S/C31H43NO8/c1-5-32-15-28(16-37-2)12-11-21(38-3)30-19-14-29(35)25(40-27(34)17-9-7-6-8-10-17)22(19)31(36,24(33)26(29)39-4)18(23(30)32)13-20(28)30/h6-10,18-26,33,35-36H,5,11-16H2,1-4H3/t18-,19+,20+,21-,22+,23+,24-,25+,26-,28-,29+,30+,31-/m0/s1
InChIKey CUEYEAKAMQYPKW-DLBWZEANSA-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 80j3tuuYmws
Name (-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-8-BETA,13-BETA,15-ALPHA-TRIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO8
InChI InChI=1S/C31H43NO8/c1-5-32-15-28(16-37-2)12-11-21(38-3)30-19-14-29(35)25(40-27(34)17-9-7-6-8-10-17)22(19)31(36,24(33)26(29)39-4)18(23(30)32)13-20(28)30/h6-10,18-26,33,35-36H,5,11-16H2,1-4H3/t18-,19+,20+,21-,22+,23+,24-,25+,26-,28-,29+,30+,31-/m0/s1
InChIKey CUEYEAKAMQYPKW-DLBWZEANSA-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 41162
Solvent ACETONE-D6