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3-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-AMINO-5H-[1,2,4]-TRIAZOLO-[4,3-B]-[1,2,4]-TRIAZOLE
SpectraBase Compound ID CNkmQq6ulrL
InChI InChI=1S/C29H24N6O7/c36-25(18-10-4-1-5-11-18)39-16-21-22(41-26(37)19-12-6-2-7-13-19)23(42-27(38)20-14-8-3-9-15-20)24(40-21)32-29-34-33-28-30-17-31-35(28)29/h1-15,17,21-24H,16H2,(H,32,34)(H,30,31,33)/t21-,22-,23-,24+/m0/s1
InChIKey VQXUOXLACGGRGD-NEWJYFPISA-N
Mol Weight 568.55 g/mol
Molecular Formula C29H24N6O7
Exact Mass 568.170647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8m9eVQVna4H
Name 3-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-AMINO-5H-[1,2,4]-TRIAZOLO-[4,3-B]-[1,2,4]-TRIAZOLE
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H24N6O7
InChI InChI=1S/C29H24N6O7/c36-25(18-10-4-1-5-11-18)39-16-21-22(41-26(37)19-12-6-2-7-13-19)23(42-27(38)20-14-8-3-9-15-20)24(40-21)32-29-34-33-28-30-17-31-35(28)29/h1-15,17,21-24H,16H2,(H,32,34)(H,30,31,33)/t21-,22-,23-,24+/m0/s1
InChIKey VQXUOXLACGGRGD-NEWJYFPISA-N
Literature Reference Author Y.H.R.JOIS,C.D.KWONG,J.M.RIORDAN,J.A.MONTGOMERY,J.A.SECRIST
Literature Reference Citation J.HETCYCL.CHEM.,30,1289(1993)
Literature Reference DOI 10.1002/jhet.5570300519
Molecular Weight 568.546 g/mol
Solvent DMSO-D6
Source File Reference UWGE856