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(1R,2S,5E)-2-[(1Z,3E)-1-(acetoxymethyl)-5-hydroxy-5-methyl-hexa-1,3-dienyl]-5-methyl-9-methylene-cyclonon-5-ene-1-carboxylic acid methyl ester

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(1R,2S,5E)-2-[(1Z,3E)-1-(acetoxymethyl)-5-hydroxy-5-methyl-hexa-1,3-dienyl]-5-methyl-9-methylene-cyclonon-5-ene-1-carboxylic acid methyl ester
SpectraBase Compound ID 7BpiO4MhbRl
InChI InChI=1S/C23H34O5/c1-16-9-7-10-17(2)21(22(25)27-6)20(13-12-16)19(15-28-18(3)24)11-8-14-23(4,5)26/h8-9,11,14,20-21,26H,2,7,10,12-13,15H2,1,3-6H3/b14-8+,16-9+,19-11+/t20-,21+/m1/s1
InChIKey QAAVINGBTKKGMU-MQQLYBRISA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8xYrWM5vkAI
Name (1R,2S,5E)-2-[(1Z,3E)-1-(acetoxymethyl)-5-hydroxy-5-methyl-hexa-1,3-dienyl]-5-methyl-9-methylene-cyclonon-5-ene-1-carboxylic acid methyl ester
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-16-9-7-10-17(2)21(22(25)27-6)20(13-12-16)19(15-28-18(3)24)11-8-14-23(4,5)26/h8-9,11,14,20-21,26H,2,7,10,12-13,15H2,1,3-6H3/b14-8+,16-9+,19-11+/t20-,21+/m1/s1
InChIKey QAAVINGBTKKGMU-MQQLYBRISA-N
Literature Reference Author E.H.ANDRIANASOLO,L.HARAMATY,K.DEGENHARDT,R.MATHEW,E.WHITE,R. LUTZ,P.FALKOWSKI
Literature Reference Citation J.NAT.PROD.,70,1551(2007)
Literature Reference DOI 10.1021/np070088v
Molecular Weight 390.520 g/mol
Sample ID 31635
Solvent CDCl3