| SpectraBase Compound ID | GgSu9QxxtXZ |
|---|---|
| InChI | InChI=1S/C15H26N5O11P3S/c1-15(2,33(24,25)26)34(27,28)31-32(3,23)29-5-7-9(21)10(22)13(30-7)20-6-17-8-11(16)18-14(35-4)19-12(8)20/h6-7,9-10,13,21-22H,5H2,1-4H3,(H,27,28)(H2,16,18,19)(H2,24,25,26)/t7-,9-,10-,13-,32?/m1/s1 |
| InChIKey | DWJWOQBFIXFYFG-TYNCEGFSSA-N |
| Mol Weight | 577.38 g/mol |
| Molecular Formula | C15H26N5O11P3S |
| Exact Mass | 577.056239 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9OabqvR7r1V |
|---|---|
| Name | 2-MES-ADENOSINE-5'-O-TRIPHOSPHATE-BETA,GAMMA-METHYLENE-CCL2;REFERENCE-43 |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C15H23N5O11P3S |
| InChI | InChI=1S/C15H26N5O11P3S/c1-15(2,33(24,25)26)34(27,28)31-32(3,23)29-5-7-9(21)10(22)13(30-7)20-6-17-8-11(16)18-14(35-4)19-12(8)20/h6-7,9-10,13,21-22H,5H2,1-4H3,(H,27,28)(H2,16,18,19)(H2,24,25,26)/t7-,9-,10-,13-,32?/m1/s1 |
| InChIKey | DWJWOQBFIXFYFG-TYNCEGFSSA-N |
| Literature Reference Author | S.ELIAHU,A.MARTIN-GIL,M.J.P.DELARA,J.PINTOR,J.CAMDEN,G.A.WEI SMAN,J.LECKA,J.SEVIG |
| Literature Reference Citation | J.MED.CHEM.,53,3305(2010) |
| Literature Reference DOI | 10.1021/jm100030u |
| Solvent | D2O |
| Source File Reference | UWIR18011 |