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CACOSPONGIOLIDE_E;MIXTURE_OF_EPIMERS
SpectraBase Compound ID Kak5mpYAtzX
InChI InChI=1S/C25H36O4/c1-16-6-5-7-21-24(16,3)12-10-17(2)25(21,4)13-11-18-8-9-20(28-15-18)19-14-22(26)29-23(19)27/h6,8,14,17,20-21,23,27H,5,7,9-13,15H2,1-4H3/t17-,20-,21-,23?,24-,25-/m0/s1
InChIKey WBDQPITVPUAHAN-HQRBXIDZSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7GNAw44bE2R
Name CACOSPONGIOLIDE_E;MIXTURE_OF_EPIMERS
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-16-6-5-7-21-24(16,3)12-10-17(2)25(21,4)13-11-18-8-9-20(28-15-18)19-14-22(26)29-23(19)27/h6,8,14,17,20-21,23,27H,5,7,9-13,15H2,1-4H3/t17-,20-,21-,23?,24-,25-/m0/s1
InChIKey WBDQPITVPUAHAN-HQRBXIDZSA-N
Literature Reference Author S.DEROSA,A.CRISPINO,A.DEGULIO,C.IODICE,R.BENREZZOUK,M.C.TERE NCIO,M.L.FERRANDIZ,M
Literature Reference Citation J.NAT.PROD.,61,931(1998)
Literature Reference DOI 10.1021/np980122t
Molecular Weight 400.558 g/mol
Solvent CDCl3
Source File Reference UWMZ545