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METHYL-4-DEOXY-3-C-[(S)-1,2-DIHYDROXYETHYL]-3,3'-ISOPROPYLIDENE-3'',6-BIS-O-(3,5-DINITROBENZOYL)-ALPHA-D-XYLOHEXOPYRANOSIDE

View entire compound with spectra: 1 NMR

METHYL-4-DEOXY-3-C-[(S)-1,2-DIHYDROXYETHYL]-3,3'-ISOPROPYLIDENE-3'',6-BIS-O-(3,5-DINITROBENZOYL)-ALPHA-D-XYLOHEXOPYRANOSIDE
SpectraBase Compound ID CdRRZOJpxKh
InChI InChI=1S/C26H26N4O17/c1-25(2)46-20(12-44-23(33)14-6-17(29(38)39)9-18(7-14)30(40)41)26(47-25)10-19(45-24(42-3)21(26)31)11-43-22(32)13-4-15(27(34)35)8-16(5-13)28(36)37/h4-9,19-21,24,31H,10-12H2,1-3H3/t19-,20?,21-,24-,26+/m1/s1
InChIKey BLVJNXZPAHRGGB-XJGJZINQSA-N
Mol Weight 666.5 g/mol
Molecular Formula C26H26N4O17
Exact Mass 666.129295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HfZmQNi5sFr
Name METHYL-4-DEOXY-3-C-[(S)-1,2-DIHYDROXYETHYL]-3,3'-ISOPROPYLIDENE-3'',6-BIS-O-(3,5-DINITROBENZOYL)-ALPHA-D-XYLOHEXOPYRANOSIDE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H26N4O17
InChI InChI=1S/C26H26N4O17/c1-25(2)46-20(12-44-23(33)14-6-17(29(38)39)9-18(7-14)30(40)41)26(47-25)10-19(45-24(42-3)21(26)31)11-43-22(32)13-4-15(27(34)35)8-16(5-13)28(36)37/h4-9,19-21,24,31H,10-12H2,1-3H3/t19-,20?,21-,24-,26+/m1/s1
InChIKey BLVJNXZPAHRGGB-XJGJZINQSA-N
Literature Reference Author A.P.RAUTER,A.C.FERNANDES,S.CZERNECKI,J.M.VALERY
Literature Reference Citation J.ORG.CHEM.,61,3594(1996)
Literature Reference DOI 10.1021/jo952220e
Molecular Weight 666.509 g/mol
Solvent CDCl3
Source File Reference UWCS21877