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PHOSPHORILATED TRITHYMIDYLATE, 5'-TRIPHOSPHATE
SpectraBase Compound ID H6az8LHYaFK
InChI InChI=1S/C30H43N6O28P5/c1-13-7-34(28(41)31-25(13)38)22-4-16(37)19(58-22)10-55-66(47,48)61-17-5-23(35-8-14(2)26(39)32-29(35)42)59-20(17)11-56-67(49,50)62-18-6-24(36-9-15(3)27(40)33-30(36)43)60-21(18)12-57-68(51,52)64-69(53,54)63-65(44,45)46/h7-9,16-24,37H,4-6,10-12H2,1-3H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,31,38,41)(H,32,39,42)(H,33,40,43)(H2,44,45,46)/t16-,17-,18-,19+,20+,21+,22+,23+,24+/m0/s1
InChIKey IBXZIRPWEFPWEF-DNIZJRTKSA-N
Mol Weight 1090.6 g/mol
Molecular Formula C30H43N6O28P5
Exact Mass 1090.08134 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6tOiHgYzS11
Name PHOSPHORILATED TRITHYMIDYLATE, 5'-TRIPHOSPHATE
Comments , SCALE INVERTED (FROM REFERENCE TEXT)!
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Formula C30H43N6O28P5
InChI InChI=1S/C30H43N6O28P5/c1-13-7-34(28(41)31-25(13)38)22-4-16(37)19(58-22)10-55-66(47,48)61-17-5-23(35-8-14(2)26(39)32-29(35)42)59-20(17)11-56-67(49,50)62-18-6-24(36-9-15(3)27(40)33-30(36)43)60-21(18)12-57-68(51,52)64-69(53,54)63-65(44,45)46/h7-9,16-24,37H,4-6,10-12H2,1-3H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,31,38,41)(H,32,39,42)(H,33,40,43)(H2,44,45,46)/t16-,17-,18-,19+,20+,21+,22+,23+,24+/m0/s1
InChIKey IBXZIRPWEFPWEF-DNIZJRTKSA-N
Instrument Name Bruker HX-90
Literature Reference A.V.LEBEDEV, A.I.REZVUKHIN (REVIEW) (1983) Bioorganich.Khim.(Russ. Lang.): v.9,N2, 149-185.
NMR Standard -H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H6SO dimethylsulfo