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NAKIJINOL_B_DIACETATE
SpectraBase Compound ID FmUhk9GQZSp
InChI InChI=1S/C26H33NO5/c1-15-8-7-9-22-25(15,5)11-10-16(2)26(22,6)13-19-23-20(27-14-30-23)12-21(31-17(3)28)24(19)32-18(4)29/h12,14,16,22H,1,7-11,13H2,2-6H3/t16-,22+,25+,26+/m0/s1
InChIKey LBTUMRYFDFRELU-NDHSLDTFSA-N
Mol Weight 439.6 g/mol
Molecular Formula C26H33NO5
Exact Mass 439.235873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtBzoJu1xw8
Name NAKIJINOL_B_DIACETATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H33NO5
InChI InChI=1S/C26H33NO5/c1-15-8-7-9-22-25(15,5)11-10-16(2)26(22,6)13-19-23-20(27-14-30-23)12-21(31-17(3)28)24(19)32-18(4)29/h12,14,16,22H,1,7-11,13H2,2-6H3/t16-,22+,25+,26+/m0/s1
InChIKey LBTUMRYFDFRELU-NDHSLDTFSA-N
Literature Reference Author S.P.B.OVENDEN,J.L.NIELSON,C.H.LIPTROT,R.H.WILLIS,D.M.TAPIOLA S,A.D.WRIGHT,C.A.MOT
Literature Reference Citation J.NAT.PROD.,74,65(2011)
Literature Reference DOI 10.1021/np100669p
Molecular Weight 439.552 g/mol
Sample ID 37708
Solvent CDCl3