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TERT.-BUTYL-N-[(2S)-2-HYDROXY-1-OXO-3-[3-(BETA-D-GLUCOPYRANOSYL)-UREIDO]-PROPYL]-PHENYLALANINATE
SpectraBase Compound ID 5vELuv3sOAb
InChI InChI=1S/C23H35N3O10/c1-23(2,3)36-21(33)13(9-12-7-5-4-6-8-12)25-19(32)14(28)10-24-22(34)26-20-18(31)17(30)16(29)15(11-27)35-20/h4-8,13-18,20,27-31H,9-11H2,1-3H3,(H,25,32)(H2,24,26,34)/t13-,14-,15-,16-,17+,18-,20-/m0/s1
InChIKey PESXJRFURBQHOP-HRQNRUDASA-N
Mol Weight 513.5 g/mol
Molecular Formula C23H35N3O10
Exact Mass 513.232244 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JRXlINZS5Qg
Name TERT.-BUTYL-N-[(2S)-2-HYDROXY-1-OXO-3-[3-(BETA-D-GLUCOPYRANOSYL)-UREIDO]-PROPYL]-PHENYLALANINATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H35N3O10
InChI InChI=1S/C23H35N3O10/c1-23(2,3)36-21(33)13(9-12-7-5-4-6-8-12)25-19(32)14(28)10-24-22(34)26-20-18(31)17(30)16(29)15(11-27)35-20/h4-8,13-18,20,27-31H,9-11H2,1-3H3,(H,25,32)(H2,24,26,34)/t13-,14-,15-,16-,17+,18-,20-/m0/s1
InChIKey PESXJRFURBQHOP-HRQNRUDASA-N
Literature Reference Author C.BOETTCHER,J.SPENGLER,L.HENNIG,F.ALBERICIO,K.BURGER
Literature Reference Citation MH.CHEM.,136,577(2005)
Literature Reference DOI 10.1007/s00706-004-0248-9
Molecular Weight 513.545 g/mol
Solvent DMSO-D6
Source File Reference UWSI23602