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(-)-(A-B)-14-ALPHA-BENZOYLOXY-8-BETA-ETHOXY-N-ETHYL-6-ALPHA,15-ALPHA-DIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
SpectraBase Compound ID 7qBYYYjzf6o
InChI InChI=1S/C33H47NO8/c1-6-34-16-31(17-38-3)14-13-21(39-4)32-20-15-19-25(42-30(37)18-11-9-8-10-12-18)22(20)33(41-7-2,29(36)26(19)40-5)23(28(32)34)24(35)27(31)32/h8-12,19-29,35-36H,6-7,13-17H2,1-5H3/t19-,20+,21-,22+,23-,24-,25-,26+,27+,28+,29-,31-,32-,33+/m0/s1
InChIKey QXMJSVFUJOETSW-ASHKKUIXSA-N
Mol Weight 585.7 g/mol
Molecular Formula C33H47NO8
Exact Mass 585.330167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bu83SHAWA80
Name (-)-(A-B)-14-ALPHA-BENZOYLOXY-8-BETA-ETHOXY-N-ETHYL-6-ALPHA,15-ALPHA-DIHYDROXY-1-ALPHA,16-BETA,18-TRIMETHOXYACONITANE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H47NO8
InChI InChI=1S/C33H47NO8/c1-6-34-16-31(17-38-3)14-13-21(39-4)32-20-15-19-25(42-30(37)18-11-9-8-10-12-18)22(20)33(41-7-2,29(36)26(19)40-5)23(28(32)34)24(35)27(31)32/h8-12,19-29,35-36H,6-7,13-17H2,1-5H3/t19-,20+,21-,22+,23-,24-,25-,26+,27+,28+,29-,31-,32-,33+/m0/s1
InChIKey QXMJSVFUJOETSW-ASHKKUIXSA-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 585.738 g/mol
Sample ID 41173
Solvent ACETONE-D6