| SpectraBase Compound ID | 2fWfuqKHMxU |
|---|---|
| InChI | InChI=1S/C56H92O13P2.3H3N/c1-41(2)21-12-22-42(3)23-13-24-43(4)25-14-26-44(5)27-15-28-45(6)29-16-30-46(7)31-17-32-47(8)33-18-34-48(9)35-19-36-49(10)37-20-38-50(11)39-40-66-70(62,63)69-71(64,65)68-56-53(59)51(57)52(58)54(67-56)55(60)61;;;/h21,23,25,27,29,31,33,35,37,39,51-54,56-59H,12-20,22,24,26,28,30,32,34,36,38,40H2,1-11H3,(H,60,61)(H,62,63)(H,64,65);3*1H3/b42-23+,43-25+,44-27+,45-29-,46-31-,47-33-,48-35-,49-37-,50-39-;;;/t51-,52-,53+,54-,56+;;;/m0.../s1 |
| InChIKey | ZLNUAYFZHCRQDL-LAECOGSCSA-N |
| Mol Weight | 1086.38 g/mol |
| Molecular Formula | C56H101N3O13P2 |
| Exact Mass | 1085.680964 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 81QG9rm6i5X |
|---|---|
| Name | ALPHA-D-GLUCOPYRANOSYLURONIC ACID, 1-MORAPRENYLPYROPHOSPHATE,TRIAMMONIUM SALT |
| Comments | , THF:DMSO=1:1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C56H101N3O13P2 |
| InChI | InChI=1S/C56H92O13P2.3H3N/c1-41(2)21-12-22-42(3)23-13-24-43(4)25-14-26-44(5)27-15-28-45(6)29-16-30-46(7)31-17-32-47(8)33-18-34-48(9)35-19-36-49(10)37-20-38-50(11)39-40-66-70(62,63)69-71(64,65)68-56-53(59)51(57)52(58)54(67-56)55(60)61;;;/h21,23,25,27,29,31,33,35,37,39,51-54,56-59H,12-20,22,24,26,28,30,32,34,36,38,40H2,1-11H3,(H,60,61)(H,62,63)(H,64,65);3*1H3/b42-23+,43-25+,44-27+,45-29-,46-31-,47-33-,48-35-,49-37-,50-39-;;;/t51-,52-,53+,54-,56+;;;/m0.../s1 |
| InChIKey | ZLNUAYFZHCRQDL-LAECOGSCSA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | L.L.DANILOV, V.N.SHIBAEV (1988) Bioorganich.Khim.(Russ. Lang.): v.14, N4, 558-559. |
| NMR Standard | not reported |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C4H8O/C2H6SO |