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METHYL 4-O-(2,3-O-ISOPROPYLIDENE-4-O-TRITYL-ALPHA-L-RHAMNOPYRANOSYL)-3-O-TRITYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
SpectraBase Compound ID JH9JOHmZSND
InChI InChI=1S/C57H55NO11/c1-37-44(67-56(38-24-12-6-13-25-38,39-26-14-7-15-27-39)40-28-16-8-17-29-40)46-49(65-54(2,3)64-46)52(61-37)62-45-47(50-53(63-48(45)51(59)60-5)69-55(4,36-58)66-50)68-57(41-30-18-9-19-31-41,42-32-20-10-21-33-42)43-34-22-11-23-35-43/h6-35,37,44-50,52-53H,1-5H3/t37-,44-,45-,46+,47-,48-,49+,50+,52-,53+,55+/m0/s1
InChIKey LYMYJQRKOVSEIG-XNGOVUSCSA-N
Mol Weight 930.1 g/mol
Molecular Formula C57H55NO11
Exact Mass 929.377512 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4xVgAI0SSJ
Name METHYL 4-O-(2,3-O-ISOPROPYLIDENE-4-O-TRITYL-ALPHA-L-RHAMNOPYRANOSYL)-3-O-TRITYL-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANURONATE
Comments W=
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C57H55NO11
InChI InChI=1S/C57H55NO11/c1-37-44(67-56(38-24-12-6-13-25-38,39-26-14-7-15-27-39)40-28-16-8-17-29-40)46-49(65-54(2,3)64-46)52(61-37)62-45-47(50-53(63-48(45)51(59)60-5)69-55(4,36-58)66-50)68-57(41-30-18-9-19-31-41,42-32-20-10-21-33-42)43-34-22-11-23-35-43/h6-35,37,44-50,52-53H,1-5H3/t37-,44-,45-,46+,47-,48-,49+,50+,52-,53+,55+/m0/s1
InChIKey LYMYJQRKOVSEIG-XNGOVUSCSA-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