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CESPITULACTAM_K

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CESPITULACTAM_K
SpectraBase Compound ID 26xCmrxKQy6
InChI InChI=1S/C28H37NO3/c1-18-5-8-21-9-12-24-26(28(21,3)4)25(17-19(2)16-23(31)15-18)29(27(24)32)14-13-20-6-10-22(30)11-7-20/h6-7,10-11,16,21,23-24,30-31H,1,5,8-9,12-15,17H2,2-4H3/b19-16+/t21-,23+,24+/m1/s1
InChIKey USYVWERWVKDSSW-KXBDFOAZSA-N
Mol Weight 435.6 g/mol
Molecular Formula C28H37NO3
Exact Mass 435.277344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5m2xId0ibXl
Name CESPITULACTAM_K
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H37NO3
InChI InChI=1S/C28H37NO3/c1-18-5-8-21-9-12-24-26(28(21,3)4)25(17-19(2)16-23(31)15-18)29(27(24)32)14-13-20-6-10-22(30)11-7-20/h6-7,10-11,16,21,23-24,30-31H,1,5,8-9,12-15,17H2,2-4H3/b19-16+/t21-,23+,24+/m1/s1
InChIKey USYVWERWVKDSSW-KXBDFOAZSA-N
Literature Reference Author Y.C.SHEN,Y.B.CHENG,J.KOBAYASHI,T.KUBOTA,Y.TAKAHASHI,Y.MIKAMI ,J.ITO,Y.S.LIN
Literature Reference Citation J.NAT.PROD.,70,1961(2007)
Literature Reference DOI 10.1021/np078011u
Molecular Weight 435.607 g/mol
Sample ID 31216
Solvent CDCl3