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(2S,6S,7R,8R,9R,E)-METHYL-7,8,10-TRIS-(BENZYLOXY)-2-(TERT.-BUTOXYCABONYLAMINO)-6,9-DIHYDROXYDEC-4-ENOATE
SpectraBase Compound ID nPSlBoIqJa
InChI InChI=1S/C37H47NO9/c1-37(2,3)47-36(42)38-30(35(41)43-4)21-14-22-31(39)33(45-24-28-17-10-6-11-18-28)34(46-25-29-19-12-7-13-20-29)32(40)26-44-23-27-15-8-5-9-16-27/h5-20,22,30-34,39-40H,21,23-26H2,1-4H3,(H,38,42)/b22-14+/t30-,31-,32+,33-,34-/m1/s1
InChIKey NKVFPJGQOXHLMU-FOUGRDDTSA-N
Mol Weight 649.8 g/mol
Molecular Formula C37H47NO9
Exact Mass 649.325082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4xspkG4t3B
Name (2S,6S,7R,8R,9R,E)-METHYL-7,8,10-TRIS-(BENZYLOXY)-2-(TERT.-BUTOXYCABONYLAMINO)-6,9-DIHYDROXYDEC-4-ENOATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H47NO9
InChI InChI=1S/C37H47NO9/c1-37(2,3)47-36(42)38-30(35(41)43-4)21-14-22-31(39)33(45-24-28-17-10-6-11-18-28)34(46-25-29-19-12-7-13-20-29)32(40)26-44-23-27-15-8-5-9-16-27/h5-20,22,30-34,39-40H,21,23-26H2,1-4H3,(H,38,42)/b22-14+/t30-,31-,32+,33-,34-/m1/s1
InChIKey NKVFPJGQOXHLMU-FOUGRDDTSA-N
Literature Reference Author E.G.NOLEN,A.J.KURISH,J.M.POTTER,L.A.DONAHUE,M.D.ORLANDO
Literature Reference Citation ORG.LETTERS,7,3383(2005)
Literature Reference DOI 10.1021/ol051341q
Molecular Weight 649.781 g/mol
Sample ID 57611
Solvent CDCl3