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(1R)-(1-(CH2OH),2,4/1,3)-2,3,4-TRI-O-BENZYL-6,6-BIS-(METHYLTHIO)-5-OXO-1,2,3,4-CYCLOHEXANETETROL

View entire compound with spectra: 1 NMR

(1R)-(1-(CH2OH),2,4/1,3)-2,3,4-TRI-O-BENZYL-6,6-BIS-(METHYLTHIO)-5-OXO-1,2,3,4-CYCLOHEXANETETROL
SpectraBase Compound ID 3cigVcAxZ8f
InChI InChI=1S/C37H40O6S2/c1-44-37(45-2)34(38)32(41-24-29-17-9-4-10-18-29)33(42-25-30-19-11-5-12-20-30)35(43-26-31-21-13-6-14-22-31)36(37,39)27-40-23-28-15-7-3-8-16-28/h3-22,32-33,35,39H,23-27H2,1-2H3/t32-,33-,35+,36-/m0/s1
InChIKey DVDVKSXYZKJCAO-RQTKNIFOSA-N
Mol Weight 644.8 g/mol
Molecular Formula C37H40O6S2
Exact Mass 644.226631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B5EKtWyyWqa
Name (1R)-(1-(CH2OH),2,4/1,3)-2,3,4-TRI-O-BENZYL-6,6-BIS-(METHYLTHIO)-5-OXO-1,2,3,4-CYCLOHEXANETETROL
CAS Registry Number 140849-67-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H40O6S2
InChI InChI=1S/C37H40O6S2/c1-44-37(45-2)34(38)32(41-24-29-17-9-4-10-18-29)33(42-25-30-19-11-5-12-20-30)35(43-26-31-21-13-6-14-22-31)36(37,39)27-40-23-28-15-7-3-8-16-28/h3-22,32-33,35,39H,23-27H2,1-2H3/t32-,33-,35+,36-/m0/s1
InChIKey DVDVKSXYZKJCAO-RQTKNIFOSA-N
Literature Reference Author H.FUKASE,S.HORII
Literature Reference Citation J.ORG.CHEM.,57,3642(1992)
Literature Reference DOI 10.1021/jo00039a025
Molecular Weight 644.841 g/mol
Solvent CDCl3
Source File Reference UWCS745