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

View entire compound with spectra: 1 NMR

METHYL 3-O-ACETYL-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
SpectraBase Compound ID 3eT6Ayi5jLd
InChI InChI=1S/C26H33NO17/c1-10(28)35-8-15-16(36-11(2)29)17(37-12(3)30)21(39-14(5)32)24(40-15)41-18-19(38-13(4)31)22-25(42-20(18)23(33)34-7)44-26(6,9-27)43-22/h15-22,24-25H,8H2,1-7H3/t15-,16-,17+,18+,19+,20+,21-,22-,24+,25-,26-/m1/s1
InChIKey QTGURKDOPWSVHX-DKEOVXDQSA-N
Mol Weight 631.5 g/mol
Molecular Formula C26H33NO17
Exact Mass 631.174849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HCIMAptjnt
Name METHYL 3-O-ACETYL-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
Comments =
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H33NO17
InChI InChI=1S/C26H33NO17/c1-10(28)35-8-15-16(36-11(2)29)17(37-12(3)30)21(39-14(5)32)24(40-15)41-18-19(38-13(4)31)22-25(42-20(18)23(33)34-7)44-26(6,9-27)43-22/h15-22,24-25H,8H2,1-7H3/t15-,16-,17+,18+,19+,20+,21-,22-,24+,25-,26-/m1/s1
InChIKey QTGURKDOPWSVHX-DKEOVXDQSA-N
Instrument Name Bruker WP-60
Literature Reference V.I.BETANELI, M.M.LITVAK, M.I.STRUCHKOVA, L.V.BAKINOVSKY, N.K.KOCHETKOV (1983)Bioorganich.Khim.(Russ. Lang.): v.9, N1, 87-103.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3