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DEACETYL-SCLEROTIORIN;5-CHLORO-3-(3,5-DIMETHYL-1,3-HEPTADIEN-1-YL)-7-HYDROXY-7-METHYL-6H-2-BENZOPYRAN-6,8(7H)-DIONE
SpectraBase Compound ID C5PPzUa3g6X
InChI InChI=1S/C19H21ClO4/c1-5-11(2)8-12(3)6-7-13-9-14-15(10-24-13)17(21)19(4,23)18(22)16(14)20/h6-11,23H,5H2,1-4H3/b7-6+,12-8+/t11?,19-/m0/s1
InChIKey SBUBEONHXLXYBK-YTLQHSAPSA-N
Mol Weight 348.83 g/mol
Molecular Formula C19H21ClO4
Exact Mass 348.112837 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B3aAIqE32i6
Name DEACETYL-SCLEROTIORIN;5-CHLORO-3-(3,5-DIMETHYL-1,3-HEPTADIEN-1-YL)-7-HYDROXY-7-METHYL-6H-2-BENZOPYRAN-6,8(7H)-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21ClO4
InChI InChI=1S/C19H21ClO4/c1-5-11(2)8-12(3)6-7-13-9-14-15(10-24-13)17(21)19(4,23)18(22)16(14)20/h6-11,23H,5H2,1-4H3/b7-6+,12-8+/t11?,19-/m0/s1
InChIKey SBUBEONHXLXYBK-YTLQHSAPSA-N
Literature Reference Author N.JANSEN,B.OHLENDORF,A.ERHARD,T.BRUHN,G.BRINGMANN,J.F.IMHOFF
Literature Reference Citation MAR.DRUGS,11,800(2013)
Literature Reference DOI 10.3390/md11030800
Molecular Weight 348.826 g/mol
Source File Reference UWLU74784