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MCWVUZREHKCRDF-PCLXORGKSA-N

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MCWVUZREHKCRDF-PCLXORGKSA-N
SpectraBase Compound ID JMb9uM9q8B3
InChI InChI=1S/C40H38O8/c1-39(2)19-18-27-32(47-39)16-14-28(36(27)44)38(46)34-29(23-7-11-25(42)12-8-23)20-40(3)21-30(34)35-33(48-40)17-13-26(37(35)45)31(43)15-6-22-4-9-24(41)10-5-22/h4-17,29-30,34,41-42,44-45H,18-21H2,1-3H3/b15-6+/t29-,30+,34-,40?/m0/s1
InChIKey MCWVUZREHKCRDF-AXFXBDBASA-N
Mol Weight 646.7 g/mol
Molecular Formula C40H38O8
Exact Mass 646.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtH8n0F95ee
Name MCWVUZREHKCRDF-PCLXORGKSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H38O8
InChI InChI=1S/C40H38O8/c1-39(2)19-18-27-32(47-39)16-14-28(36(27)44)38(46)34-29(23-7-11-25(42)12-8-23)20-40(3)21-30(34)35-33(48-40)17-13-26(37(35)45)31(43)15-6-22-4-9-24(41)10-5-22/h4-17,29-30,34,41-42,44-45H,18-21H2,1-3H3/b15-6+/t29-,30+,34-,40?/m0/s1
InChIKey MCWVUZREHKCRDF-AXFXBDBASA-N
Literature Reference Author B.M.ABEGAZ,B.T.NGADJUI,E.DONGO,B.NGAMENI,M.N.NINDI,M.BEZABIH
Literature Reference Citation PHYTOCHEM.,59,877(2002)
Literature Reference DOI 10.1016/S0031-9422(01)00483-6
Molecular Weight 646.737 g/mol
Solvent CDCl3