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BETA-D-GLUCOPYRANOSE-1,2,6-TRIS-(PYRROLE-2-CARBOXYLATE);BUPRESTIN-A
SpectraBase Compound ID EiE3alGtVCj
InChI InChI=1S/C21H21N3O9/c25-15-14(10-30-18(27)11-4-1-7-22-11)31-21(33-20(29)13-6-3-9-24-13)17(16(15)26)32-19(28)12-5-2-8-23-12/h1-9,14-17,21-26H,10H2/t14-,15-,16+,17-,21+/m1/s1
InChIKey PEWLFUFCUXJGIA-IALVOCICSA-N
Mol Weight 459.41 g/mol
Molecular Formula C21H21N3O9
Exact Mass 459.127779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IxiA6Z1nu2x
Name BETA-D-GLUCOPYRANOSE-1,2,6-TRIS-(PYRROLE-2-CARBOXYLATE);BUPRESTIN-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21N3O9
InChI InChI=1S/C21H21N3O9/c25-15-14(10-30-18(27)11-4-1-7-22-11)31-21(33-20(29)13-6-3-9-24-13)17(16(15)26)32-19(28)12-5-2-8-23-12/h1-9,14-17,21-26H,10H2/t14-,15-,16+,17-,21+/m1/s1
InChIKey PEWLFUFCUXJGIA-IALVOCICSA-N
Literature Reference Author W.V.BROWN,A.J.JONES,M.J.LACEY,B.P.MOORE
Literature Reference Citation AUSTR.J.CHEM.,38,197(1985)
Literature Reference DOI 10.1071/ch9850197
Molecular Weight 459.412 g/mol
Solvent DMSO-D6
Source File Reference UNIW22036