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CAF-603-LINOLEATE

View entire compound with spectra: 1 NMR

CAF-603-LINOLEATE
SpectraBase Compound ID 9GDvTd70o00
InChI InChI=1S/C33H56O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31(34)36-30-26-32(5)25-24-28(4)22-23-29(32)33(30,35)27(2)3/h10-11,13-14,24,27,29-30,35H,6-9,12,15-23,25-26H2,1-5H3/b11-10+,14-13+/t29-,30+,32+,33-/m1/s1
InChIKey LMFZLTVFRAEZAV-LGIPLMFESA-N
Mol Weight 500.8 g/mol
Molecular Formula C33H56O3
Exact Mass 500.422946 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8IuYJyfXS1t
Name CAF-603-LINOLEATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H56O3
InChI InChI=1S/C33H56O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-31(34)36-30-26-32(5)25-24-28(4)22-23-29(32)33(30,35)27(2)3/h10-11,13-14,24,27,29-30,35H,6-9,12,15-23,25-26H2,1-5H3/b11-10+,14-13+/t29-,30+,32+,33-/m1/s1
InChIKey LMFZLTVFRAEZAV-LGIPLMFESA-N
Literature Reference Author S.H.LEE,O.D.HENSENS,G.L.HELMS,J.M.LIESCH,D.L.ZINK,R.A.GIACOB BE,G.F.BILLS,S.STEVE
Literature Reference Citation J.NAT.PROD.,58,1822(1995)
Literature Reference DOI 10.1021/np50126a004
Molecular Weight 500.806 g/mol
Solvent CD2Cl2
Source File Reference UWCS23387