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METHYL 3,4-DI-O-(2,3,4-TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
SpectraBase Compound ID LrV6MonFbPJ
InChI InChI=1S/C34H45NO21/c1-12-20(46-14(3)36)22(48-16(5)38)27(50-18(7)40)31(44-12)52-24-25(29-33(54-26(24)30(42)43-10)56-34(9,11-35)55-29)53-32-28(51-19(8)41)23(49-17(6)39)21(13(2)45-32)47-15(4)37/h12-13,20-29,31-33H,1-10H3/t12-,13-,20-,21-,22+,23+,24-,25-,26-,27+,28+,29+,31-,32-,33+,34+/m0/s1
InChIKey RNJPSVUDSHLWCB-YFIOPJJGSA-N
Mol Weight 803.7 g/mol
Molecular Formula C34H45NO21
Exact Mass 803.248407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6qtBgObeaa
Name METHYL 3,4-DI-O-(2,3,4-TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
Comments 3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C34H45NO21
InChI InChI=1S/C34H45NO21/c1-12-20(46-14(3)36)22(48-16(5)38)27(50-18(7)40)31(44-12)52-24-25(29-33(54-26(24)30(42)43-10)56-34(9,11-35)55-29)53-32-28(51-19(8)41)23(49-17(6)39)21(13(2)45-32)47-15(4)37/h12-13,20-29,31-33H,1-10H3/t12-,13-,20-,21-,22+,23+,24-,25-,26-,27+,28+,29+,31-,32-,33+,34+/m0/s1
InChIKey RNJPSVUDSHLWCB-YFIOPJJGSA-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