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Voruscharin, (3.beta.-R,5.alpha.-H)
SpectraBase Compound ID cebpxj1ECb
InChI InChI=1S/C31H43NO8S/c1-17-13-30(32-9-10-41-30)31(36)26(38-17)39-23-12-19-3-4-22-21(28(19,16-33)14-24(23)40-31)5-7-27(2)20(6-8-29(22,27)35)18-11-25(34)37-15-18/h11,16-17,19-24,26,32,35-36H,3-10,12-15H2,1-2H3/t17-,19+,20-,21+,22-,23-,24-,26+,27-,28-,29+,30?,31-/m1/s1
InChIKey YLDBWOUPHZGCJG-ACOVAQOJSA-N
Mol Weight 589.7 g/mol
Molecular Formula C31H43NO8S
Exact Mass 589.270939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YubwmR0e4R
Name VORUSCHARIN,(3-BETA-R,5-ALPHA-H)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO8S
InChI InChI=1S/C31H43NO8S/c1-17-13-30(32-9-10-41-30)31(36)26(38-17)39-23-12-19-3-4-22-21(28(19,16-33)14-24(23)40-31)5-7-27(2)20(6-8-29(22,27)35)18-11-25(34)37-15-18/h11,16-17,19-24,26,32,35-36H,3-10,12-15H2,1-2H3/t17-,19+,20-,21+,22-,23-,24-,26+,27-,28-,29+,30?,31-/m1/s1
InChIKey YLDBWOUPHZGCJG-ACOVAQOJSA-N
Literature Reference Author S.M.LEE,J.N.SEIBER
Literature Reference Citation PHYTOCHEM.,22,923(1983)
Literature Reference DOI 10.1016/0031-9422(83)85022-5
Molecular Weight 589.744 g/mol
Solvent CDCl3
Source File Reference UNIW8440