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(-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-1-ALPHA,8-BETA,15-ALPHA-TRIHYDROXY-16-BETA,18-DIMETHOXYACONITANE
SpectraBase Compound ID Dd9jxQR2PKV
InChI InChI=1S/C30H41NO7/c1-4-31-14-28(15-36-2)11-10-21(32)29-18-12-17-23(38-27(34)16-8-6-5-7-9-16)22(18)30(35,26(33)24(17)37-3)19(25(29)31)13-20(28)29/h5-9,17-26,32-33,35H,4,10-15H2,1-3H3/t17-,18+,19-,20+,21-,22+,23-,24+,25+,26-,28-,29+,30-/m0/s1
InChIKey NTGKCQGZLZSKEW-OHZMOMTHSA-N
Mol Weight 527.7 g/mol
Molecular Formula C30H41NO7
Exact Mass 527.288303 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVTOInpE0kw
Name (-)-(A-B)-14-ALPHA-BENZOYLOXY-N-ETHYL-1-ALPHA,8-BETA,15-ALPHA-TRIHYDROXY-16-BETA,18-DIMETHOXYACONITANE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H41NO7
InChI InChI=1S/C30H41NO7/c1-4-31-14-28(15-36-2)11-10-21(32)29-18-12-17-23(38-27(34)16-8-6-5-7-9-16)22(18)30(35,26(33)24(17)37-3)19(25(29)31)13-20(28)29/h5-9,17-26,32-33,35H,4,10-15H2,1-3H3/t17-,18+,19-,20+,21-,22+,23-,24+,25+,26-,28-,29+,30-/m0/s1
InChIKey NTGKCQGZLZSKEW-OHZMOMTHSA-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 527.658 g/mol
Sample ID 41175
Solvent ACETONE-D6