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METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE

View entire compound with spectra: 1 NMR

METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE
SpectraBase Compound ID IhcekpGn7VP
InChI InChI=1S/C24H31NO16/c1-9(26)33-7-13-14(30)15(34-10(2)27)19(36-12(4)29)22(37-13)38-17-16(35-11(3)28)18(21(31)32-6)39-23-20(17)40-24(5,8-25)41-23/h13-20,22-23,30H,7H2,1-6H3/t13-,14-,15+,16+,17+,18+,19-,20-,22+,23-,24-/m1/s1
InChIKey FQKOEMOWRFPJCN-CKHBJTDNSA-N
Mol Weight 589.5 g/mol
Molecular Formula C24H31NO16
Exact Mass 589.164284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IPR45gZq5K5
Name METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE
Comments 6>
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Formula C24H31NO16
InChI InChI=1S/C24H31NO16/c1-9(26)33-7-13-14(30)15(34-10(2)27)19(36-12(4)29)22(37-13)38-17-16(35-11(3)28)18(21(31)32-6)39-23-20(17)40-24(5,8-25)41-23/h13-20,22-23,30H,7H2,1-6H3/t13-,14-,15+,16+,17+,18+,19-,20-,22+,23-,24-/m1/s1
InChIKey FQKOEMOWRFPJCN-CKHBJTDNSA-N
Instrument Name Bruker WM-250
Literature Reference V.I.BETANELI, A.YA.OTT (1991) Bioorganich.Khim.(Russ. Lang.): v.17, N10, 1390-1400.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3