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[2-[BENZOYL-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-AMINO]-ACETYLAMINO]-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID AJB1e4CNPOy
InChI InChI=1S/2C26H32N2O13/c2*1-14(29)37-13-19-22(38-15(2)30)23(39-16(3)31)24(40-17(4)32)26(41-19)28(12-20(33)27-11-21(34)36-5)25(35)18-9-7-6-8-10-18/h2*6-10,19,22-24,26H,11-13H2,1-5H3,(H,27,33)/t2*19-,22+,23+,24-,26-/m00/s1
InChIKey AOLPAUOEFDROAM-PJXXWHMOSA-N
Mol Weight 1161.1 g/mol
Molecular Formula C52H64N4O26
Exact Mass 1160.380878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID R1GvYtU1uv
Name [2-[BENZOYL-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-AMINO]-ACETYLAMINO]-ACETIC-ACID-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H64N4O26
InChI InChI=1S/2C26H32N2O13/c2*1-14(29)37-13-19-22(38-15(2)30)23(39-16(3)31)24(40-17(4)32)26(41-19)28(12-20(33)27-11-21(34)36-5)25(35)18-9-7-6-8-10-18/h2*6-10,19,22-24,26H,11-13H2,1-5H3,(H,27,33)/t2*19-,22+,23+,24-,26-/m00/s1
InChIKey AOLPAUOEFDROAM-PJXXWHMOSA-N
Literature Reference Author P.V.MURPHY,H.BRADLEY,M.TOSIN,N.PITT,G.M.FITZPATRICK,W.K.GLAS S
Literature Reference Citation J.ORG.CHEM.,68,5692(2003)
Literature Reference DOI 10.1021/jo034336d
Molecular Weight 1161.091 g/mol
Solvent CDCl3
Source File Reference UWLU24251