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PYRANONIGRIN_S;3-HYDROXY-2-[(1-E)-PROP-1-ENYL]-6,7-DIHYDROPYRANO-[2.3-C]-PYRROLE-4,5-DIONE
SpectraBase Compound ID 6tP6rQDUwOx
InChI InChI=1S/C10H9NO4/c1-2-3-5-8(12)9(13)7-6(15-5)4-11-10(7)14/h2-3,12H,4H2,1H3,(H,11,14)/b3-2+
InChIKey CBJUACYAKSDFBO-NSCUHMNNSA-N
Mol Weight 207.18 g/mol
Molecular Formula C10H9NO4
Exact Mass 207.053158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EEVJhEOOmuY
Name PYRANONIGRIN_S;3-HYDROXY-2-[(1-E)-PROP-1-ENYL]-6,7-DIHYDROPYRANO-[2.3-C]-PYRROLE-4,5-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H9NO4
InChI InChI=1S/C10H9NO4/c1-2-3-5-8(12)9(13)7-6(15-5)4-11-10(7)14/h2-3,12H,4H2,1H3,(H,11,14)/b3-2+
InChIKey CBJUACYAKSDFBO-NSCUHMNNSA-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 207.186 g/mol
Sample ID 30647
Solvent DMSO-D6