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(3S,4R,4AR,10AS)-3,4,4A,5,10,10A-HEXAHYDRO-3,4-DIHYDROXY-7-METHYL-8-(METHYLTHIO)-2H-PYRANO-[3,2-G]-PTERIDIN-6(7H)-ONE
SpectraBase Compound ID 8A3K4ZLZ2Wl
InChI InChI=1S/C11H16N4O4S/c1-15-10(18)6-8(14-11(15)20-2)13-9-5(12-6)7(17)4(16)3-19-9/h4-5,7,9,12-13,16-17H,3H2,1-2H3/t4-,5+,7-,9-/m0/s1
InChIKey BNMFXTOQZVHUKK-CJNGXTTDSA-N
Mol Weight 300.33 g/mol
Molecular Formula C11H16N4O4S
Exact Mass 300.089226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9XIwAnXh99
Name (3S,4R,4AR,10AS)-3,4,4A,5,10,10A-HEXAHYDRO-3,4-DIHYDROXY-7-METHYL-8-(METHYLTHIO)-2H-PYRANO-[3,2-G]-PTERIDIN-6(7H)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H16N4O4S
InChI InChI=1S/C11H16N4O4S/c1-15-10(18)6-8(14-11(15)20-2)13-9-5(12-6)7(17)4(16)3-19-9/h4-5,7,9,12-13,16-17H,3H2,1-2H3/t4-,5+,7-,9-/m0/s1
InChIKey BNMFXTOQZVHUKK-CJNGXTTDSA-N
Literature Reference Author R.SOYKA,W.PFLEIDERER,R.PREWO
Literature Reference Citation HELV.CHIM.ACTA,73,808(1990)
Literature Reference DOI 10.1002/hlca.19900730407
Molecular Weight 300.332 g/mol
Solvent DMSO-D6
Source File Reference UWED14633