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PLAKORTOLIDE_J;(3-S,4-S,6-S,15-E,17-E,19-E)-4,6-DIMETHYL-4-HYDROXY-3,6-PEROXYDOCOSA-15,17,19-TRIENOIC_ACID_1,4-LACTONE
SpectraBase Compound ID 8Q6whKk36t9
InChI InChI=1S/C24H38O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(2)20-24(3)21(27-28-23)19-22(25)26-24/h5-10,21H,4,11-20H2,1-3H3/b6-5+,8-7+,10-9+/t21-,23-,24-/m0/s1
InChIKey AXDQPRBNYTZNDV-FONNPZOSSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YftbIDd9ta
Name PLAKORTOLIDE_J;(3-S,4-S,6-S,15-E,17-E,19-E)-4,6-DIMETHYL-4-HYDROXY-3,6-PEROXYDOCOSA-15,17,19-TRIENOIC_ACID_1,4-LACTONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(2)20-24(3)21(27-28-23)19-22(25)26-24/h5-10,21H,4,11-20H2,1-3H3/b6-5+,8-7+,10-9+/t21-,23-,24-/m0/s1
InChIKey AXDQPRBNYTZNDV-FONNPZOSSA-N
Literature Reference Author C.JIMENEZ-ROMERO,I.ORTIZ,J.VICENTE,B.VERAMA.D.RODRIGUEZ,S.NA M,R.JOVE
Literature Reference Citation J.NAT.PROD.,73,1694(2010)
Literature Reference DOI 10.1021/np100461t
Molecular Weight 390.563 g/mol
Sample ID 36053
Solvent CDCl3