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14-HYDROXY-CAF-603-OLEATE

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14-HYDROXY-CAF-603-OLEATE
SpectraBase Compound ID 2k0ZpqN1Pzx
InChI InChI=1S/C33H58O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(35)37-26-28-21-22-29-32(4,24-23-28)25-30(34)33(29,36)27(2)3/h12-13,23,27,29-30,34,36H,5-11,14-22,24-26H2,1-4H3/b13-12+/t29-,30+,32+,33-/m1/s1
InChIKey IRNSDAKENNBILA-PUENRADPSA-N
Mol Weight 518.8 g/mol
Molecular Formula C33H58O4
Exact Mass 518.43351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNWyztbOJ9b
Name 14-HYDROXY-CAF-603-OLEATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H58O4
InChI InChI=1S/C33H58O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31(35)37-26-28-21-22-29-32(4,24-23-28)25-30(34)33(29,36)27(2)3/h12-13,23,27,29-30,34,36H,5-11,14-22,24-26H2,1-4H3/b13-12+/t29-,30+,32+,33-/m1/s1
InChIKey IRNSDAKENNBILA-PUENRADPSA-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 518.821 g/mol
Solvent CD3OD
Source File Reference UWCS23383