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5-ACETYL-1,6-DIHYDRO-4-BETA-D-(2',3',4',6'-TETRA-O-ACETYL)-GLUCOPYRANOSYLAMINO-2-METHYLTHIO-6-OXOPYRIMIDINE
SpectraBase Compound ID 27ciTPOE1FL
InChI InChI=1S/C21H27N3O11S/c1-8(25)14-18(23-21(36-6)24-19(14)30)22-20-17(34-12(5)29)16(33-11(4)28)15(32-10(3)27)13(35-20)7-31-9(2)26/h13,15-17,20H,7H2,1-6H3,(H2,22,23,24,30)
InChIKey NBQZSFDMOHOAAV-UHFFFAOYSA-N
Mol Weight 529.52 g/mol
Molecular Formula C21H27N3O11S
Exact Mass 529.13663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FWzlkwUTTz
Name 5-ACETYL-1,6-DIHYDRO-4-BETA-D-(2',3',4',6'-TETRA-O-ACETYL)-GLUCOPYRANOSYLAMINO-2-METHYLTHIO-6-OXOPYRIMIDINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27N3O11S
InChI InChI=1S/C21H27N3O11S/c1-8(25)14-18(23-21(36-6)24-19(14)30)22-20-17(34-12(5)29)16(33-11(4)28)15(32-10(3)27)13(35-20)7-31-9(2)26/h13,15-17,20H,7H2,1-6H3,(H2,22,23,24,30)
InChIKey NBQZSFDMOHOAAV-UHFFFAOYSA-N
Literature Reference Author A.S.RODRIGO,M.N.MONTIEL,J.C.DELACASA,R.A.ASENJO,M.M.SAMPEDRO
Literature Reference Citation HETEROCYCLES,23,1961(1985)
Literature Reference DOI 10.3987/R-1985-08-1961
Molecular Weight 529.519 g/mol
Solvent CDCl3
Source File Reference UWED8282