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2-[(2',2'-DIMETHYLPROPYL)-THIOETHER]-ADENOSINE-5'-TRIPHOSPHATE

Compound with spectra: 2 NMR

2-[(2',2'-DIMETHYLPROPYL)-THIOETHER]-ADENOSINE-5'-TRIPHOSPHATE
SpectraBase Compound ID BnS1qmYPdCY
InChI InChI=1S/C15H26N5O13P3S/c1-15(2,3)5-37-14-18-11(16)8-12(19-14)20(6-17-8)13-10(22)9(21)7(31-13)4-30-35(26,27)33-36(28,29)32-34(23,24)25/h6-7,9-10,13,21-22H,4-5H2,1-3H3,(H,26,27)(H,28,29)(H2,16,18,19)(H2,23,24,25)/p-4/t7-,9-,10-,13-/m0/s1
InChIKey DRFFSPPSTOORJN-PYSAPBNWSA-J
Mol Weight 605.34 g/mol
Molecular Formula C15H22N5O13P3S
Exact Mass 605.014768 g/mol
Enantiomer InChIKey DRFFSPPSTOORJN-QYVSTXNMSA-J

View Spectrum of 2-[(2',2'-DIMETHYLPROPYL)-THIOETHER]-ADENOSINE-5'-TRIPHOSPHATE

15N NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O;PH=5.36

View Spectrum of 2-[(2',2'-DIMETHYLPROPYL)-THIOETHER]-ADENOSINE-5'-TRIPHOSPHATE

31P NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent H2O;PH=5.36D2O
2-(METHYL-THIOETHER)-ADENOSINE-5'-TRIPHOSPHATE
2-SME-ATP-ALPHA-B;A-ISOMER
2-MES-ADENOSINE-5'-O-DIPHOSPHATE-ALPHA,BETA-DIFLUOROMETHYLENE
3-ACETYL-1-RIBOFURANOSYLPYRIDINIUM HYDROXIDE, 5' TO 5'-ESTER WITH ADENOSINE 5'-DIPHOSPHATE, INNER SALT, DIHYDRATE
3-CARBAMOYL-1-RIBOFURANOSYLPYRIDINIUM HYDROXIDE, 5' TO 5'-ESTER WITH INOSINE 5'-DIPHOSPHATE, INNER SALT, MONOSODIUM SALT, MONOHYDRATE
3-CARBAMOYL-1-beta-D-RIBOFURANOSYLPYRIDINIUM HYDROXIDE, 5'TO 5'-ESTER WITH ADENOSINE 5'-(TRIHYDROGEN PYROPHOSPHATE), INNER SALT, TRIHYDRATE
3-FORMYL-1-RIBOFURANOSYLPYRIDINIUM HYDROXIDE, 5' TO 5'-ESTER WITH ADENOSINE 5'-DIPHOSPHATE, INNER SALT, TRIHYDRATE
1-RIBOFURANOSYL-3-(THIOCARBAMOYL)PYRIDINIUM HYDROXIDE, 5' TO 5'-ESTER WITH ADENOSINE 5'-DIPHOSPHATE, INNER SALT
ADENOSINE 5'-DIPHOSPHATE, 5' TO 5'-ESTER WITH 3-CARBOXY-1,4-DIHYDRO-1-beta-D-RIBOFURANOSYLPYRIDINE, DISODIUM SALT, TRIHYDRATE
A5P;ADENOSINE-5'-TRIPHOSPHATE-3'-DIPHOSPHATE
Title Journal or Book Year
Protonation Studies of Modified Adenine and Adenine Nucleotides by Theoretical Calculations and 15N NMR The Journal of Organic Chemistry 2002
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