![METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-4-O-TRITYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE](/api/spectrum/Lq0pqlAd6yi/structure.png?h=300&w=458 "METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-4-O-TRITYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE")
| SpectraBase Compound ID | JVZafGUj73s |
|---|---|
| InChI | InChI=1S/C43H45NO16/c1-24(45)51-22-31-32(59-43(28-16-10-7-11-17-28,29-18-12-8-13-19-29)30-20-14-9-15-21-30)33(52-25(2)46)37(54-27(4)48)40(55-31)56-35-34(53-26(3)47)36(39(49)50-6)57-41-38(35)58-42(5,23-44)60-41/h7-21,31-38,40-41H,22H2,1-6H3/t31-,32-,33+,34+,35+,36+,37-,38-,40+,41-,42-/m1/s1 |
| InChIKey | RGRMMIBKBUDOBZ-OMWAWVMPSA-N |
| Mol Weight | 831.8 g/mol |
| Molecular Formula | C43H45NO16 |
| Exact Mass | 831.273834 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lq0pqlAd6yi |
|---|---|
| Name | METHYL 4-O-ACETYL-3-O-(2,3,6-TRI-O-ACETYL-4-O-TRITYL-BETA-D-GLUCOPYRANOSYL)-1,2-O-[1-(EXO-CYANO)ETHYLIDENE]-ALPHA-D-GLUCOPYRANOSYLURONATE |
| Comments | 1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C43H45NO16 |
| InChI | InChI=1S/C43H45NO16/c1-24(45)51-22-31-32(59-43(28-16-10-7-11-17-28,29-18-12-8-13-19-29)30-20-14-9-15-21-30)33(52-25(2)46)37(54-27(4)48)40(55-31)56-35-34(53-26(3)47)36(39(49)50-6)57-41-38(35)58-42(5,23-44)60-41/h7-21,31-38,40-41H,22H2,1-6H3/t31-,32-,33+,34+,35+,36+,37-,38-,40+,41-,42-/m1/s1 |
| InChIKey | RGRMMIBKBUDOBZ-OMWAWVMPSA-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 |