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CASEARINONE-A
SpectraBase Compound ID 2wbOV078ll
InChI InChI=1S/C26H36O8/c1-8-14(2)9-10-25(7)15(3)11-22(30)26-20(12-19(13-21(25)26)31-16(4)27)23(32-17(5)28)34-24(26)33-18(6)29/h8-9,15,19-21,23-24H,1,10-13H2,2-7H3/b14-9+/t15-,19-,20+,21+,23+,24-,25-,26-/m0/s1
InChIKey IHEGPSNNXNVYDQ-ASRBLDRASA-N
Mol Weight 476.6 g/mol
Molecular Formula C26H36O8
Exact Mass 476.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COAC7Pcq5xf
Name CASEARINONE-A
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O8
InChI InChI=1S/C26H36O8/c1-8-14(2)9-10-25(7)15(3)11-22(30)26-20(12-19(13-21(25)26)31-16(4)27)23(32-17(5)28)34-24(26)33-18(6)29/h8-9,15,19-21,23-24H,1,10-13H2,2-7H3/b14-9+/t15-,19-,20+,21+,23+,24-,25-,26-/m0/s1
InChIKey IHEGPSNNXNVYDQ-ASRBLDRASA-N
Literature Reference Author M.S.HUNTER,D.G.CORLEY,C.P.CARRON,E.ROWOLD,B.F.KILPATRICK,R.C .DURLEY
Literature Reference Citation J.NAT.PROD.,60,894(1997)
Literature Reference DOI 10.1021/np970141n
Molecular Weight 476.567 g/mol
Solvent CDCl3
Source File Reference UWRU509