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TERT.-BUTYL_N-BENZOYLGLYCYL-N-[2-OXO-2-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-AMINO]-ETHYL]-GLYCYLGLYCINATE;MINOR_ISOMER
SpectraBase Compound ID 7b8iHpAUDLs
InChI InChI=1S/C33H44N4O15/c1-18(38)47-17-23-28(48-19(2)39)29(49-20(3)40)30(50-21(4)41)32(51-23)36-25(43)16-37(15-24(42)34-14-27(45)52-33(5,6)7)26(44)13-35-31(46)22-11-9-8-10-12-22/h8-12,23,28-30,32H,13-17H2,1-7H3,(H,34,42)(H,35,46)(H,36,43)/t23-,28-,29+,30-,32-/m1/s1
InChIKey HLMNVSKNZDHEJN-ZCJRLKOSSA-N
Mol Weight 736.7 g/mol
Molecular Formula C33H44N4O15
Exact Mass 736.280317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxM5OoLCtxd
Name TERT.-BUTYL_N-BENZOYLGLYCYL-N-[2-OXO-2-[(2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-AIMNO]-ETHYL]-GLYCYLGLYCINATE;MAJOR_ISOMER
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H44N4O15
InChI InChI=1S/C33H44N4O15/c1-18(38)47-17-23-28(48-19(2)39)29(49-20(3)40)30(50-21(4)41)32(51-23)36-25(43)16-37(15-24(42)34-14-27(45)52-33(5,6)7)26(44)13-35-31(46)22-11-9-8-10-12-22/h8-12,23,28-30,32H,13-17H2,1-7H3,(H,34,42)(H,35,46)(H,36,43)/t23-,28-,29+,30-,32-/m1/s1
InChIKey HLMNVSKNZDHEJN-ZCJRLKOSSA-N
Literature Reference Author K.BURGER,C.BOETTCHER,L.HENNIG,S.A.ESSAWY
Literature Reference Citation MH.CHEM.,135,865(2004)
Molecular Weight 736.730 g/mol
Solvent CDCl3
Source File Reference UWMZ12015