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3-O-ETHYLPYRANONIGRIN_A;3-ETHOXY-7-HYDROXY-2-[(1-E)-PROP-1-ENYL]-6,7-DIHYDROPYRANO-[2.3-C]-PYRROLE-4,5-DIONE
SpectraBase Compound ID FPFpR1pKqwU
InChI InChI=1S/C12H13NO5/c1-3-5-6-9(17-4-2)8(14)7-10(18-6)12(16)13-11(7)15/h3,5,12,16H,4H2,1-2H3,(H,13,15)/b5-3+
InChIKey HSAHKTDZWNXJNS-HWKANZROSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7grFMCnu0lR
Name 3-O-ETHYLPYRANONIGRIN_A;3-ETHOXY-7-HYDROXY-2-[(1-E)-PROP-1-ENYL]-6,7-DIHYDROPYRANO-[2.3-C]-PYRROLE-4,5-DIONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c1-3-5-6-9(17-4-2)8(14)7-10(18-6)12(16)13-11(7)15/h3,5,12,16H,4H2,1-2H3,(H,13,15)/b5-3+
InChIKey HSAHKTDZWNXJNS-HWKANZROSA-N
Literature Reference Author G.SCHLINGMANN,T.TANIGUCHI,H.HE,R.BIGELIS,H.Y.YANG,F.E.KOEHN, G.T.CARTER,N.BEROVA
Literature Reference Citation J.NAT.PROD.,70,1180(2007)
Literature Reference DOI 10.1021/np070175n
Molecular Weight 251.239 g/mol
Sample ID 30653
Solvent DMSO-D6