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PHYSORDINOSE_A
SpectraBase Compound ID AWeAVjXf7gC
InChI InChI=1S/C34H58O15/c1-7-8-9-10-11-12-13-14-15-16-25(38)45-29-28(46-31(41)20(2)3)26(39)23(17-35)44-33(29)49-34(19-43-22(6)37)30(47-32(42)21(4)5)27(40)24(18-36)48-34/h20-21,23-24,26-30,33,35-36,39-40H,7-19H2,1-6H3/t23-,24-,26-,27-,28+,29-,30+,33-,34+/m1/s1
InChIKey ATIWROIXDFLFKP-JUAKHFSCSA-N
Mol Weight 706.8 g/mol
Molecular Formula C34H58O15
Exact Mass 706.377571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JA2fkb4ecVu
Name PHYSORDINOSE_A
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H58O15
InChI InChI=1S/C34H58O15/c1-7-8-9-10-11-12-13-14-15-16-25(38)45-29-28(46-31(41)20(2)3)26(39)23(17-35)44-33(29)49-34(19-43-22(6)37)30(47-32(42)21(4)5)27(40)24(18-36)48-34/h20-21,23-24,26-30,33,35-36,39-40H,7-19H2,1-6H3/t23-,24-,26-,27-,28+,29-,30+,33-,34+/m1/s1
InChIKey ATIWROIXDFLFKP-JUAKHFSCSA-N
Literature Reference Author A.L.PEREZ-CASTORENA,M.MARTINEZ,E.MALDONADO
Literature Reference Citation J.NAT.PROD.,73,1271(2010)
Literature Reference DOI 10.1021/np100127k
Molecular Weight 706.826 g/mol
Sample ID 36465
Solvent CDCl3