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XYCPTPBGBNPCNF-UHFFFAOYSA-N
SpectraBase Compound ID EUApSCKURKR
InChI InChI=1S/C72H140N8O8/c1-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-47-54-77(55-48-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-2)61-64-62-80(76-75-64)58-51-63(59-78(67(83)87-71(9,10)11)56-49-45-52-73-65(81)85-69(3,4)5)60-79(68(84)88-72(12,13)14)57-50-46-53-74-66(82)86-70(6,7)8/h62-63H,15-61H2,1-14H3,(H,73,81)(H,74,82)
InChIKey XYCPTPBGBNPCNF-UHFFFAOYSA-N
Mol Weight 1246.0 g/mol
Molecular Formula C72H140N8O8
Exact Mass 1245.079413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eux0U1ugnSW
Name XYCPTPBGBNPCNF-UHFFFAOYSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H140N8O8
InChI InChI=1S/C72H140N8O8/c1-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-47-54-77(55-48-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-2)61-64-62-80(76-75-64)58-51-63(59-78(67(83)87-71(9,10)11)56-49-45-52-73-65(81)85-69(3,4)5)60-79(68(84)88-72(12,13)14)57-50-46-53-74-66(82)86-70(6,7)8/h62-63H,15-61H2,1-14H3,(H,73,81)(H,74,82)
InChIKey XYCPTPBGBNPCNF-UHFFFAOYSA-N
Literature Reference Author M.JEAN,M.L.ROCH,J.RENAULT,P.URIAC
Literature Reference Citation ORG.LETTERS,7,2663(2005)
Literature Reference DOI 10.1021/ol050803x
Molecular Weight 1245.952 g/mol
Sample ID 43034
Solvent CDCl3