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XQGGUPWPBXHLPC-OUKQBFOZSA-N
SpectraBase Compound ID EVO8XYmTGAs
InChI InChI=1S/C31H53NO9/c1-10-21-14-17(3)23(33)12-13-31(7)29(41-31)20(6)25(11-2)39-26(35)16-24(34)19(5)28(21)40-30-27(36)22(32(8,9)37)15-18(4)38-30/h12-13,17-22,24-25,27-30,34,36H,10-11,14-16H2,1-9H3/b13-12+
InChIKey XQGGUPWPBXHLPC-OUKQBFOZSA-N
Mol Weight 583.8 g/mol
Molecular Formula C31H53NO9
Exact Mass 583.372032 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtB0cDy0lGH
Name XQGGUPWPBXHLPC-OUKQBFOZSA-N
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H53NO9
InChI InChI=1S/C31H53NO9/c1-10-21-14-17(3)23(33)12-13-31(7)29(41-31)20(6)25(11-2)39-26(35)16-24(34)19(5)28(21)40-30-27(36)22(32(8,9)37)15-18(4)38-30/h12-13,17-22,24-25,27-30,34,36H,10-11,14-16H2,1-9H3/b13-12+
InChIKey XQGGUPWPBXHLPC-OUKQBFOZSA-N
Literature Reference Author M.S.PUAR,D.SCHUMACHER
Literature Reference Citation J.ANTIBIOTICS,43,1497(1990)
Literature Reference DOI 10.7164/antibiotics.43.1497
Molecular Weight 583.763 g/mol
Sample ID 40569
Solvent CDCl3