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CONIOSETIN
SpectraBase Compound ID IJdoUdMdQTq
InChI InChI=1S/C25H35NO4/c1-6-7-8-9-18-15(3)13-17-12-14(2)10-11-19(17)25(18,5)23(29)20-22(28)21(16(4)27)26-24(20)30/h6-9,13-14,16-19,21,27,29H,10-12H2,1-5H3,(H,26,30)/b7-6+,9-8+,23-20+/t14-,16?,17+,18-,19-,21?,25-/m1/s1
InChIKey ISHIUSZGAFLPLK-MSLMHWDWSA-N
Mol Weight 413.6 g/mol
Molecular Formula C25H35NO4
Exact Mass 413.256609 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56Cr7PS5Qsq
Name CONIOSETIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H35NO4
InChI InChI=1S/C25H35NO4/c1-6-7-8-9-18-15(3)13-17-12-14(2)10-11-19(17)25(18,5)23(29)20-22(28)21(16(4)27)26-24(20)30/h6-9,13-14,16-19,21,27,29H,10-12H2,1-5H3,(H,26,30)/b7-6+,9-8+,23-20+/t14-,16?,17+,18-,19-,21?,25-/m1/s1
InChIKey ISHIUSZGAFLPLK-MSLMHWDWSA-N
Literature Reference Author M.P.SEGETH,A.BONNEFOY,M.BROENSTRUP,M.KNAUF,D.SCHUMMER,L.TOTI ,L.VERTESY,M.C.WETZE
Literature Reference Citation J.ANTIBIOTICS,56,114(2003)
Literature Reference DOI 10.7164/antibiotics.56.114
Molecular Weight 413.557 g/mol
Solvent CD3OD
Source File Reference UWSI4426