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TUMONOIC_ACID_H
SpectraBase Compound ID D4Cu9oALg8u
InChI InChI=1S/C26H45NO7/c1-7-8-9-10-11-12-14-19(6)23(28)27-16-13-15-20(27)25(31)34-22(18(4)5)26(32)33-21(17(2)3)24(29)30/h17-22H,7-16H2,1-6H3,(H,29,30)/t19-,20-,21+,22+/m0/s1
InChIKey XZDDLHQSVWZOPD-FNAHDJPLSA-N
Mol Weight 483.6 g/mol
Molecular Formula C26H45NO7
Exact Mass 483.319603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L4DMDHyiCWE
Name TUMONOIC_ACID_H
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H45NO7
InChI InChI=1S/C26H45NO7/c1-7-8-9-10-11-12-14-19(6)23(28)27-16-13-15-20(27)25(31)34-22(18(4)5)26(32)33-21(17(2)3)24(29)30/h17-22H,7-16H2,1-6H3,(H,29,30)/t19-,20-,21+,22+/m0/s1
InChIKey XZDDLHQSVWZOPD-FNAHDJPLSA-N
Literature Reference Author B.R.CLARK,N.ENGENE,M.E.TEASDALE,D.C.ROWLEY,T.MATAINAHO,F.A.V ALERIOTE,W.H.GERWICK
Literature Reference Citation J.NAT.PROD.,71,1530(2008)
Literature Reference DOI 10.1021/np800088a
Molecular Weight 483.646 g/mol
Sample ID 29014
Solvent CDCl3