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2',3'-O-ISOPROPYLIDENE-5'-S-PROPARGYL-5'-THIOADENOSINE

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2',3'-O-ISOPROPYLIDENE-5'-S-PROPARGYL-5'-THIOADENOSINE
SpectraBase Compound ID CsWMe3toDOl
InChI InChI=1S/C16H19N5O3S/c1-4-5-25-6-9-11-12(24-16(2,3)23-11)15(22-9)21-8-20-10-13(17)18-7-19-14(10)21/h1,7-9,11-12,15H,5-6H2,2-3H3,(H2,17,18,19)/t9-,11-,12-,15-/m1/s1
InChIKey AKVMZQBHJOWPEL-SDBHATRESA-N
Mol Weight 361.42 g/mol
Molecular Formula C16H19N5O3S
Exact Mass 361.120861 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KmiJZwNgA5q
Name 2',3'-O-ISOPROPYLIDENE-5'-S-PROPARGYL-5'-THIOADENOSINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H19N5O3S
InChI InChI=1S/C16H19N5O3S/c1-4-5-25-6-9-11-12(24-16(2,3)23-11)15(22-9)21-8-20-10-13(17)18-7-19-14(10)21/h1,7-9,11-12,15H,5-6H2,2-3H3,(H2,17,18,19)/t9-,11-,12-,15-/m1/s1
InChIKey AKVMZQBHJOWPEL-SDBHATRESA-N
Literature Reference Author G.GUILLERM,D.GIULLERM,C.VANDENPLAS-WITKOWKI,H.ROGNIAUX,N.CAR TE,E.LEIZE,A.V.DORSS
Literature Reference Citation J.MED.CHEM.,44,2743(2001)
Literature Reference DOI 10.1021/jm0108350
Molecular Weight 361.419 g/mol
Sample ID 52821
Solvent CDCl3