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MILITARIN;[(2R)-2-HYDROXY-2-(2-METHYLPROPYL)-1,4-DIOXO-1,4-BUTANE-DIYL]-BIS-(OXYMETHYLENE-4,1-PHENYLENE)-BIS-BETA-D-GLUCOPYRANOSIDE

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MILITARIN;[(2R)-2-HYDROXY-2-(2-METHYLPROPYL)-1,4-DIOXO-1,4-BUTANE-DIYL]-BIS-(OXYMETHYLENE-4,1-PHENYLENE)-BIS-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 8Yjjmm2WWYu
InChI InChI=1S/C34H46O17/c1-17(2)11-34(45,33(44)47-16-19-5-9-21(10-6-19)49-32-30(43)28(41)26(39)23(14-36)51-32)12-24(37)46-15-18-3-7-20(8-4-18)48-31-29(42)27(40)25(38)22(13-35)50-31/h3-10,17,22-23,25-32,35-36,38-43,45H,11-16H2,1-2H3/t22-,23+,25-,26+,27+,28-,29-,30+,31-,32+,34-/m1/s1
InChIKey GQNUDXCKVPLQBI-DLAQUDBRSA-N
Mol Weight 726.7 g/mol
Molecular Formula C34H46O17
Exact Mass 726.2735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7VVh0re3Ks6
Name MILITARIN;[(2R)-2-HYDROXY-2-(2-METHYLPROPYL)-1,4-DIOXO-1,4-BUTANE-DIYL]-BIS-(OXYMETHYLENE-4,1-PHENYLENE)-BIS-BETA-D-GLUCOPYRANOSIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H46O17
InChI InChI=1S/C34H46O17/c1-17(2)11-34(45,33(44)47-16-19-5-9-21(10-6-19)49-32-30(43)28(41)26(39)23(14-36)51-32)12-24(37)46-15-18-3-7-20(8-4-18)48-31-29(42)27(40)25(38)22(13-35)50-31/h3-10,17,22-23,25-32,35-36,38-43,45H,11-16H2,1-2H3/t22-,23+,25-,26+,27+,28-,29-,30+,31-,32+,34-/m1/s1
InChIKey GQNUDXCKVPLQBI-DLAQUDBRSA-N
Literature Reference Author B.B.COTA,A.MAGALHAES,A.M.C.PIMENTA,E.P.SIQUEIRA,T.M.A.ALVES, C.L.ZANI
Literature Reference Citation J.BRAZ.CHEM.SOC.,19,1098(2008)
Literature Reference DOI 10.1590/s0103-50532008000600007
Molecular Weight 726.729 g/mol
Source File Reference UWIR5234