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2',3',5'-tri-o-Acetyl-8-hydroxyadenosine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2',3',5'-tri-o-Acetyl-8-hydroxyadenosine
SpectraBase Compound ID JH7f6C2JRH5
InChI InChI=1S/C16H19N5O8/c1-6(22)26-4-9-11(27-7(2)23)12(28-8(3)24)15(29-9)21-14-10(20-16(21)25)13(17)18-5-19-14/h5,9,11-12,15H,4H2,1-3H3,(H,20,25)(H2,17,18,19)
InChIKey XBTPYFOEAANLLR-UHFFFAOYSA-N
Mol Weight 409.36 g/mol
Molecular Formula C16H19N5O8
Exact Mass 409.123363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EjMPDOsXoco
Name 2',3',5'-tri-o-Acetyl-8-hydroxyadenosine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.123362584 u
Formula C16H19N5O8
InChI InChI=1S/C16H19N5O8/c1-6(22)26-4-9-11(27-7(2)23)12(28-8(3)24)15(29-9)21-14-10(20-16(21)25)13(17)18-5-19-14/h5,9,11-12,15H,4H2,1-3H3,(H,20,25)(H2,17,18,19)
InChIKey XBTPYFOEAANLLR-UHFFFAOYSA-N
Molecular Weight 409.355 g/mol
SMILES C1(N2C(=NC3=C2N=CN=C3N)O)C(C(OC(=O)C)C(O1)COC(=O)C)OC(=O)C