| SpectraBase Compound ID | CEyhPLnLkXE |
|---|---|
| InChI | InChI=1S/C22H32N3O16P/c1-9(27)23-15-19(31)18(30)14(40-21(15)38-12-5-3-11(4-6-12)25(33)34)8-37-42(35,36)41-22-16(24-10(2)28)20(32)17(29)13(7-26)39-22/h3-6,13-22,26,29-32H,7-8H2,1-2H3,(H,23,27)(H,24,28)(H,35,36)/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-/m1/s1 |
| InChIKey | VEPDEGTVWJGZRB-HWQNPIRBSA-N |
| Mol Weight | 625.5 g/mol |
| Molecular Formula | C22H32N3O16P |
| Exact Mass | 625.152019 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GqvAPhlu5Zs |
|---|---|
| Name | PARA-NITROPHENYL 2-ACETAMIDO-2-DEOXY-6-O-(2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSYLPHOSPHO)-BETA-D-GLUCOPYRANOSIDE |
| Comments | , NH4HCO3 - 0.1M |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H32N3O16P |
| InChI | InChI=1S/C22H32N3O16P/c1-9(27)23-15-19(31)18(30)14(40-21(15)38-12-5-3-11(4-6-12)25(33)34)8-37-42(35,36)41-22-16(24-10(2)28)20(32)17(29)13(7-26)39-22/h3-6,13-22,26,29-32H,7-8H2,1-2H3,(H,23,27)(H,24,28)(H,35,36)/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-/m1/s1 |
| InChIKey | VEPDEGTVWJGZRB-HWQNPIRBSA-N |
| Instrument Name | Bruker AM-300 |
| Literature Reference | V.N.SHIBAEV, G.I.ELISEEVA, D.DZHORUPBEKOVA, N.K.KOCHETKOV (1987)Bioorganich.Khim.(Russ. Lang.): v.13, N7, 940-946. |
| NMR Standard | not reported |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O deuterium oxide |