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3-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-N-(3-CARBOXYPROPIONYL)-L-SERINE-11-METHOXYCARBONYLUNDECANAMIDE
SpectraBase Compound ID HitufY8XVeR
InChI InChI=1S/C34H54N2O16/c1-21(37)47-20-26-30(49-22(2)38)31(50-23(3)39)32(51-24(4)40)34(52-26)48-19-25(36-27(41)16-17-28(42)43)33(45)35-18-14-12-10-8-6-7-9-11-13-15-29(44)46-5/h25-26,30-32,34H,6-20H2,1-5H3,(H,35,45)(H,36,41)(H,42,43)/t25?,26-,30+,31+,32-,34-/m1/s1
InChIKey QNFMQTOMTZJLRH-OPSBAKMKSA-N
Mol Weight 746.8 g/mol
Molecular Formula C34H54N2O16
Exact Mass 746.347334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBaHIxytH8y
Name 3-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-N-(3-CARBOXYPROPIONYL)-L-SERINE-11-METHOXYCARBONYLUNDECANAMIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H54N2O16
InChI InChI=1S/C34H54N2O16/c1-21(37)47-20-26-30(49-22(2)38)31(50-23(3)39)32(51-24(4)40)34(52-26)48-19-25(36-27(41)16-17-28(42)43)33(45)35-18-14-12-10-8-6-7-9-11-13-15-29(44)46-5/h25-26,30-32,34H,6-20H2,1-5H3,(H,35,45)(H,36,41)(H,42,43)/t25?,26-,30+,31+,32-,34-/m1/s1
InChIKey QNFMQTOMTZJLRH-OPSBAKMKSA-N
Literature Reference Author B.FAROUX-CORLAY,J.GREINER,R.TERREUX,D.CABROL-BASS,A.M.AUBERT IN,P.VIERLING,J.FANT
Literature Reference Citation J.MED.CHEM.,44,2188(2001)
Literature Reference DOI 10.1021/jm0011124
Molecular Weight 746.807 g/mol
Sample ID 44582
Solvent CDCl3