| SpectraBase Compound ID | 8Src4Z4iHe4 |
|---|---|
| InChI | InChI=1S/C6H15O13P3.6Na/c7-3-2(1-20(9,10)11)18-6(21(12,13)14)5(4(3)8)19-22(15,16)17;;;;;;/h2-8H,1H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17);;;;;;/q;6*+1/p-6/t2-,3+,4+,5-,6+;;;;;;/m1....../s1 |
| InChIKey | GFIMECUOADFEBD-GUTAAOODSA-H |
| Mol Weight | 519.98490169 g/mol |
| Molecular Formula | C6H9Na6O13P3 |
| Exact Mass | 519.864217 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 26ax7swDvtK |
|---|---|
| Name | HEXASODIUM-(6-DEOXY-6-C,2-O-DIPHOSPHONATO-BETA-D-GALACTOPYRANOSYL)-PHOSPHONATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H9Na6O13P3 |
| InChI | InChI=1S/C6H15O13P3.6Na/c7-3-2(1-20(9,10)11)18-6(21(12,13)14)5(4(3)8)19-22(15,16)17;;;;;;/h2-8H,1H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17);;;;;;/q;6*+1/p-6/t2-,3+,4+,5-,6+;;;;;;/m1....../s1 |
| InChIKey | GFIMECUOADFEBD-GUTAAOODSA-H |
| Literature Reference Author | L.CZOLLNER,G.BAUDIN,B.BERNET,A.VASELLA |
| Literature Reference Citation | HELV.CHIM.ACTA,76,1013(1993) |
| Literature Reference DOI | 10.1002/hlca.19930760224 |
| Molecular Weight | 519.990 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS15192 |