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N-(BENZYLOXYCARBONYL)-(2R)-(2,4-DIOXO-1-METHYL-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-(4S)-HYDROXY-(5R)-HYDROXYMETHYL-PYRROLIDINE
SpectraBase Compound ID 1olDSDaGfyM
InChI InChI=1S/2C18H21N3O6/c2*1-20-8-12(16(24)19-17(20)25)13-7-15(23)14(9-22)21(13)18(26)27-10-11-5-3-2-4-6-11/h2*2-6,8,13-15,22-23H,7,9-10H2,1H3,(H,19,24,25)/t2*13-,14-,15+/m11/s1
InChIKey ZUGCCXNDNMOQMC-RJKXKWSTSA-N
Mol Weight 750.76 g/mol
Molecular Formula C36H42N6O12
Exact Mass 750.286071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ES0vUwKzhdQ
Name N-(BENZYLOXYCARBONYL)-(2R)-(2,4-DIOXO-1-METHYL-1,2,3,4-TETRAHYDROPYRIMIDIN-5-YL)-(4S)-HYDROXY-(5R)-HYDROXYMETHYL-PYRROLIDINE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H42N6O12
InChI InChI=1S/2C18H21N3O6/c2*1-20-8-12(16(24)19-17(20)25)13-7-15(23)14(9-22)21(13)18(26)27-10-11-5-3-2-4-6-11/h2*2-6,8,13-15,22-23H,7,9-10H2,1H3,(H,19,24,25)/t2*13-,14-,15+/m11/s1
InChIKey ZUGCCXNDNMOQMC-RJKXKWSTSA-N
Literature Reference Author A.HABERLI,C.J.LEUMANN
Literature Reference Citation ORG.LETTERS,3,489(2001)
Literature Reference DOI 10.1021/ol007029s
Molecular Weight 750.762 g/mol
Solvent DMSO-D6
Source File Reference UWLU35409