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(-)-(A-B)-8-BETA-ACETOXY-14-ALPHA-BENZOYLOXY-N-ETHYL-3-ALPHA,10-BETA,13-BETA-TRIHYDROXY-1-ALPHA,6-ALPHA,16-BETA,18-TETRAMETHOXYACONITANE
SpectraBase Compound ID 3O8Y4G66HH8
InChI InChI=1S/C31H43NO11/c1-32-13-27(14-39-2)16(33)11-17(40-3)30-20(27)19(41-4)18(22(30)32)31(38)21-24(43-26(35)15-9-7-6-8-10-15)28(36,12-29(21,30)37)25(42-5)23(31)34/h6-10,16-25,33-34,36-38H,11-14H2,1-5H3/t16-,17+,18+,19+,20-,21+,22-,23+,24-,25+,27+,28-,29+,30-,31+/m1/s1
InChIKey BWSPOWYGDDPLQY-BRZJUHBGSA-N
Mol Weight 605.7 g/mol
Molecular Formula C31H43NO11
Exact Mass 605.283611 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9jWRqzvGp5
Name (-)-(A-B)-8-BETA-ACETOXY-14-ALPHA-BENZOYLOXY-N-ETHYL-3-ALPHA,10-BETA,13-BETA-TRIHYDROXY-1-ALPHA,6-ALPHA,16-BETA,18-TETRAMETHOXYACONITANE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO11
InChI InChI=1S/C31H43NO11/c1-32-13-27(14-39-2)16(33)11-17(40-3)30-20(27)19(41-4)18(22(30)32)31(38)21-24(43-26(35)15-9-7-6-8-10-15)28(36,12-29(21,30)37)25(42-5)23(31)34/h6-10,16-25,33-34,36-38H,11-14H2,1-5H3/t16-,17+,18+,19+,20-,21+,22-,23+,24-,25+,27+,28-,29+,30-,31+/m1/s1
InChIKey BWSPOWYGDDPLQY-BRZJUHBGSA-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 605.683 g/mol
Sample ID 41153
Solvent ACETONE-D6