| SpectraBase Compound ID | 5Q6YhmZKVtH |
|---|---|
| InChI | InChI=1S/C22H32N3O16P.H3N/c1-9(28)23-15-19(32)17(30)13(7-26)39-22(15)41-42(35,36)40-20-16(24-10(2)29)21(38-14(8-27)18(20)31)37-12-5-3-11(4-6-12)25(33)34;/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)(H,35,36);1H3/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-;/m1./s1 |
| InChIKey | GCOCYUISFNKFOI-BMJHLPJYSA-N |
| Mol Weight | 642.51 g/mol |
| Molecular Formula | C22H35N4O16P |
| Exact Mass | 642.178568 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AM7URtYIiKW |
|---|---|
| Name | 3-O-(2-DEOXY-2-ACETAMIDO-ALPHA-D-GLUCOPYRANOSYLOXYPHOSPHORYL)-2-DEOXY-2-ACETAMIDO-1-PARA-NITROPHENYL-BETA-D-GLUCOPYRANOSE, AMMONIUM SALT |
| Comments | , NAME DEFINED |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C22H35N4O16P |
| InChI | InChI=1S/C22H32N3O16P.H3N/c1-9(28)23-15-19(32)17(30)13(7-26)39-22(15)41-42(35,36)40-20-16(24-10(2)29)21(38-14(8-27)18(20)31)37-12-5-3-11(4-6-12)25(33)34;/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)(H,35,36);1H3/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-;/m1./s1 |
| InChIKey | GCOCYUISFNKFOI-BMJHLPJYSA-N |
| Instrument Name | Bruker AC-200 |
| Literature Reference | A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV (1990) Bioorganich.Khim.(Russ. Lang.):v.16, N12, 1693-1695. |
| NMR Standard | not reported |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O deuterium oxide |