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6-O-METHYLPALLENIC-ACID-METHYLESTER
SpectraBase Compound ID 8QAGzjszYlt
InChI InChI=1S/C23H30O9/c1-9-10-14(24)15-17(28-6)12(2)16(27-5)13-11-21(3)19(25)32-22(4,20(26)29-7)23(21,30-8)31-18(13)15/h9-11H2,1-8H3/t21-,22-,23-/m1/s1
InChIKey ALDKZKPBTVVVLZ-DNVJHFABSA-N
Mol Weight 450.48 g/mol
Molecular Formula C23H30O9
Exact Mass 450.188983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KFjTxLd8XD4
Name 6-O-METHYLPALLENIC-ACID-METHYLESTER
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H30O9
InChI InChI=1S/C23H30O9/c1-9-10-14(24)15-17(28-6)12(2)16(27-5)13-11-21(3)19(25)32-22(4,20(26)29-7)23(21,30-8)31-18(13)15/h9-11H2,1-8H3/t21-,22-,23-/m1/s1
InChIKey ALDKZKPBTVVVLZ-DNVJHFABSA-N
Literature Reference Author T.LOBO-ECHEVERRI,J.F.RIVERO-CRUZ,B.N.SU,H.B.CHAI,G.A.CORDELL ,J.M.PEZZUTO,S.M.SWA
Literature Reference Citation J.NAT.PROD.,68,577(2005)
Literature Reference DOI 10.1021/np0496688
Molecular Weight 450.486 g/mol
Solvent CD3OD
Source File Reference UWMZ9638