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NJWKIDPWYBLMFY-QJYJJIJTSA-N
SpectraBase Compound ID L7KExO9oPtC
InChI InChI=1S/C40H41N3O16/c1-22(44)51-20-28-31(53-23(2)45)30(42-43-41)33(54-24(3)46)40(56-28)59-32-29(21-52-36(47)25-14-8-5-9-15-25)55-39(50-4)35(58-38(49)27-18-12-7-13-19-27)34(32)57-37(48)26-16-10-6-11-17-26/h5-19,28-35,39-40H,20-21H2,1-4H3/t28-,29-,30+,31-,32-,33-,34+,35-,39+,40+/m0/s1
InChIKey NJWKIDPWYBLMFY-QJYJJIJTSA-N
Mol Weight 819.8 g/mol
Molecular Formula C40H41N3O16
Exact Mass 819.248682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rj3Gxa7LIZ
Name NJWKIDPWYBLMFY-QJYJJIJTSA-N
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H41N3O16
InChI InChI=1S/C40H41N3O16/c1-22(44)51-20-28-31(53-23(2)45)30(42-43-41)33(54-24(3)46)40(56-28)59-32-29(21-52-36(47)25-14-8-5-9-15-25)55-39(50-4)35(58-38(49)27-18-12-7-13-19-27)34(32)57-37(48)26-16-10-6-11-17-26/h5-19,28-35,39-40H,20-21H2,1-4H3/t28-,29-,30+,31-,32-,33-,34+,35-,39+,40+/m0/s1
InChIKey NJWKIDPWYBLMFY-QJYJJIJTSA-N
Literature Reference Author Z.SZURMAI,J.RAKO,K.AGOSTON,A.DANAN,D.CHARON
Literature Reference Citation ORG.LETTERS,2,1839(2000)
Literature Reference DOI 10.1021/ol0058893
Molecular Weight 819.776 g/mol
Solvent Unknown
Source File Reference UWSI25898