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1-[4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE]-ACETYL-L-GLYCYL-L-VALINE-METHYLESTER
SpectraBase Compound ID HMa2xN7tkp8
InChI InChI=1S/C16H23N7O6/c1-8(2)11(15(27)29-5)18-9(24)6-17-10(25)7-23-12-13(19-20-23)21(3)16(28)22(4)14(12)26/h8,11H,6-7H2,1-5H3,(H,17,25)(H,18,24)/t11-/m0/s1
InChIKey XXQOLWULAXVFHR-NSHDSACASA-N
Mol Weight 409.4 g/mol
Molecular Formula C16H23N7O6
Exact Mass 409.170981 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4iwgus591yJ
Name 1-[4,6-DIMETHYL-1H-[1,2,3]-TRIAZOLO-[4,5-D]-PYRIMIDINE-5,7(4H,6H)-DIONE]-ACETYL-L-GLYCYL-L-VALINE-METHYLESTER
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H23N7O6
InChI InChI=1S/C16H23N7O6/c1-8(2)11(15(27)29-5)18-9(24)6-17-10(25)7-23-12-13(19-20-23)21(3)16(28)22(4)14(12)26/h8,11H,6-7H2,1-5H3,(H,17,25)(H,18,24)/t11-/m0/s1
InChIKey XXQOLWULAXVFHR-NSHDSACASA-N
Literature Reference Author A.A.H.ABDEL-RAHMAN
Literature Reference Citation MH.CHEM.,139,61(2008)
Literature Reference DOI 10.1007/s00706-007-0745-8
Molecular Weight 409.402 g/mol
Sample ID 39630
Solvent DMSO-D6