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[2-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(3-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-CARBAMOYLPROPIONYL)-AMINO]-ACETYLAMINO]-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID FJn5kMmgdJd
InChI InChI=1S/C37H51N3O23/c1-16(41)54-14-24-30(56-18(3)43)32(58-20(5)45)34(60-22(7)47)36(62-24)39-26(49)10-11-28(51)40(13-27(50)38-12-29(52)53-9)37-35(61-23(8)48)33(59-21(6)46)31(57-19(4)44)25(63-37)15-55-17(2)42/h24-25,30-37H,10-15H2,1-9H3,(H,38,50)(H,39,49)/t24-,25-,30+,31+,32+,33+,34-,35-,36-,37-/m0/s1
InChIKey NLGQVPLMGPSKFN-HJCREUPOSA-N
Mol Weight 905.8 g/mol
Molecular Formula C37H51N3O23
Exact Mass 905.291335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RVmYSk27dW
Name [2-[2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(3-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-CARBAMOYLPROPIONYL)-AMINO]-ACETYLAMINO]-ACETIC-ACID-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H51N3O23
InChI InChI=1S/C37H51N3O23/c1-16(41)54-14-24-30(56-18(3)43)32(58-20(5)45)34(60-22(7)47)36(62-24)39-26(49)10-11-28(51)40(13-27(50)38-12-29(52)53-9)37-35(61-23(8)48)33(59-21(6)46)31(57-19(4)44)25(63-37)15-55-17(2)42/h24-25,30-37H,10-15H2,1-9H3,(H,38,50)(H,39,49)/t24-,25-,30+,31+,32+,33+,34-,35-,36-,37-/m0/s1
InChIKey NLGQVPLMGPSKFN-HJCREUPOSA-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 905.818 g/mol
Solvent CDCl3
Source File Reference UWLU24277