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METHYL-5-ACETAMIDO-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,4,5-TRIDEOXY-4-C-[1-(METHOXYCARBONYL)-ETHENYL]-D-GLYCERO-D-GALACTO-NON-2-ENONATE
SpectraBase Compound ID 1TPdONjtwlu
InChI InChI=1S/C22H29NO12/c1-10(21(28)30-6)15-8-16(22(29)31-7)35-20(18(15)23-11(2)24)19(34-14(5)27)17(33-13(4)26)9-32-12(3)25/h8,15,17-20H,1,9H2,2-7H3,(H,23,24)/t15-,17+,18-,19-,20-/m1/s1
InChIKey VHJIQIIDEOSWHO-HKUYMTLNSA-N
Mol Weight 499.47 g/mol
Molecular Formula C22H29NO12
Exact Mass 499.168975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6FLWf0JXIi
Name METHYL-5-ACETAMIDO-7,8,9-TRI-O-ACETYL-2,6-ANHYDRO-3,4,5-TRIDEOXY-4-C-[1-(METHOXYCARBONYL)-ETHENYL]-D-GLYCERO-D-GALACTO-NON-2-ENONATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO12
InChI InChI=1S/C22H29NO12/c1-10(21(28)30-6)15-8-16(22(29)31-7)35-20(18(15)23-11(2)24)19(34-14(5)27)17(33-13(4)26)9-32-12(3)25/h8,15,17-20H,1,9H2,2-7H3,(H,23,24)/t15-,17+,18-,19-,20-/m1/s1
InChIKey VHJIQIIDEOSWHO-HKUYMTLNSA-N
Literature Reference Author G.B.KOK,M.VONITZSTEIN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,905(1998)
Literature Reference DOI 10.1039/p29740000905
Molecular Weight 499.472 g/mol
Solvent CDCl3
Source File Reference UWGE2416