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5-AMINO-1,5-DIDEOXY-1-(3,4-DIHYDRO-5-METHYL-2,4-DIOXO-1(2H)-PYRIMIDINYL)-BETA-D-ALLOFURAN-URONIC-ACID
SpectraBase Compound ID 37CMviQdspV
InChI InChI=1S/C11H15N3O7/c1-3-2-14(11(20)13-8(3)17)9-6(16)5(15)7(21-9)4(12)10(18)19/h2,4-7,9,15-16H,12H2,1H3,(H,18,19)(H,13,17,20)/t4?,5-,6+,7+,9+/m1/s1
InChIKey WJIRSAPNZWSQLD-OFGGPQPOSA-N
Mol Weight 301.26 g/mol
Molecular Formula C11H15N3O7
Exact Mass 301.091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5BATaA69lrk
Name 5-AMINO-1,5-DIDEOXY-1-(3,4-DIHYDRO-5-METHYL-2,4-DIOXO-1(2H)-PYRIMIDINYL)-BETA-D-ALLOFURAN-URONIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H15N3O7
InChI InChI=1S/C11H15N3O7/c1-3-2-14(11(20)13-8(3)17)9-6(16)5(15)7(21-9)4(12)10(18)19/h2,4-7,9,15-16H,12H2,1H3,(H,18,19)(H,13,17,20)/t4?,5-,6+,7+,9+/m1/s1
InChIKey WJIRSAPNZWSQLD-OFGGPQPOSA-N
Literature Reference Author P.GARNER,J.M.PARK
Literature Reference Citation J.ORG.CHEM.,55,3772(1990)
Literature Reference DOI 10.1021/jo00299a017
Molecular Weight 301.256 g/mol
Solvent DMSO-D6:D2O
Source File Reference UWED12491