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PLAKORTIDE-M;(3S,4S,6R,7E,10R,11E)-3,6-EPIDIOXY-4,6,10-TRIETHYLTETRADECA-7,11-DIENOIC-ACID
SpectraBase Compound ID B9ZkwnzP9AW
InChI InChI=1S/C20H34O4/c1-5-9-11-16(6-2)12-10-13-20(8-4)15-17(7-3)18(23-24-20)14-19(21)22/h9-11,13,16-18H,5-8,12,14-15H2,1-4H3,(H,21,22)/b11-9+,13-10+/t16-,17-,18-,20-/m0/s1
InChIKey APFBSUUYUMZERZ-ACISTPACSA-N
Mol Weight 338.5 g/mol
Molecular Formula C20H34O4
Exact Mass 338.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 76ocYA9v9nE
Name PLAKORTIDE-M;(3S,4S,6R,7E,10R,11E)-3,6-EPIDIOXY-4,6,10-TRIETHYLTETRADECA-7,11-DIENOIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O4
InChI InChI=1S/C20H34O4/c1-5-9-11-16(6-2)12-10-13-20(8-4)15-17(7-3)18(23-24-20)14-19(21)22/h9-11,13,16-18H,5-8,12,14-15H2,1-4H3,(H,21,22)/b11-9+,13-10+/t16-,17-,18-,20-/m0/s1
InChIKey APFBSUUYUMZERZ-ACISTPACSA-N
Literature Reference Author M.D.S.JIMENEZ,S.P.GARZON,A.D.RODRIGUEZ
Literature Reference Citation J.NAT.PROD.,66,655(2003)
Literature Reference DOI 10.1021/np030021h
Molecular Weight 338.488 g/mol
Solvent CDCl3
Source File Reference UWSI7738