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11-O-METHYLPSEUROTIN_A

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11-O-METHYLPSEUROTIN_A
SpectraBase Compound ID DVbTjMxpNWs
InChI InChI=1S/C23H27NO8/c1-5-6-12-15(30-3)16(25)17-13(2)18(26)22(32-17)20(28)23(31-4,24-21(22)29)19(27)14-10-8-7-9-11-14/h6-12,15-16,20,25,28H,5H2,1-4H3,(H,24,29)/b12-6-/t15-,16-,20+,22+,23+/m0/s1
InChIKey BSXLPZRKEPWAAT-CHZVKGAWSA-N
Mol Weight 445.47 g/mol
Molecular Formula C23H27NO8
Exact Mass 445.173667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AIRivrvbWk6
Name 11-O-METHYLPSEUROTIN_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H27NO8
InChI InChI=1S/C23H27NO8/c1-5-6-12-15(30-3)16(25)17-13(2)18(26)22(32-17)20(28)23(31-4,24-21(22)29)19(27)14-10-8-7-9-11-14/h6-12,15-16,20,25,28H,5H2,1-4H3,(H,24,29)/b12-6-/t15-,16-,20+,22+,23+/m0/s1
InChIKey BSXLPZRKEPWAAT-CHZVKGAWSA-N
Literature Reference Author C.M.BOOT,N.C.GASSNER,J.E.COMPTON,K.TENNEY,C.M.TAMBLE,R.S.LOK EY,T.R.HOLMAN,P.CREW
Literature Reference Citation J.NAT.PROD.,70,1672(2007)
Literature Reference DOI 10.1021/np070307c
Molecular Weight 445.469 g/mol
Sample ID 31726
Solvent CD3OD