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1,9A-SECO-STEMOENONINE

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1,9A-SECO-STEMOENONINE
SpectraBase Compound ID Dmpmv8AwEPr
InChI InChI=1S/C22H27NO8/c1-4-13-18-15(30-22(13)10-12(3)21(28)31-22)6-5-7-23(19(18)26)14(9-17(24)25)16-8-11(2)20(27)29-16/h9-11,13,15-16,18H,4-8H2,1-3H3,(H,24,25)/b14-9-/t11-,13-,15+,16-,18-,22-/m0/s1
InChIKey JUYMQCOCANDESC-ILJPQRDMSA-N
Mol Weight 433.46 g/mol
Molecular Formula C22H27NO8
Exact Mass 433.173667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dBYVWq5rWI
Name 1,9A-SECO-STEMOENONINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H27NO8
InChI InChI=1S/C22H27NO8/c1-4-13-18-15(30-22(13)10-12(3)21(28)31-22)6-5-7-23(19(18)26)14(9-17(24)25)16-8-11(2)20(27)29-16/h9-11,13,15-16,18H,4-8H2,1-3H3,(H,24,25)/b14-9-/t11-,13-,15+,16-,18-,22-/m0/s1
InChIKey JUYMQCOCANDESC-ILJPQRDMSA-N
Literature Reference Author L.G.LI,K.M.LI,C.P.TANG,C.Q.KE,J.A.RUDD,G.LIN,Y.YE
Literature Reference Citation J.NAT.PROD.,71,1107(2008)
Literature Reference DOI 10.1021/np070651+
Molecular Weight 433.458 g/mol
Sample ID 28550
Solvent CDCl3