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(2R,3S)-2-Acetyl-2,5,12-trihydroxy-3-fluoro-1,2,3,4-tetrahydro-naphthacene-6,11-dione
SpectraBase Compound ID EKlMN3WZx2W
InChI InChI=1S/C20H15FO6/c1-8(22)20(27)7-12-11(6-13(20)21)18(25)14-15(19(12)26)17(24)10-5-3-2-4-9(10)16(14)23/h2-5,13,25-27H,6-7H2,1H3/t13-,20+/m0/s1
InChIKey SOMNBKPPFFWMGL-RNODOKPDSA-N
Mol Weight 370.33 g/mol
Molecular Formula C20H15FO6
Exact Mass 370.085266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcPJSazRXjJ
Name (2R,3S)-2-Acetyl-2,5,12-trihydroxy-3-fluoro-1,2,3,4-tetrahydro-naphthacene-6,11-dione
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Formula C20H15FO6
InChI InChI=1S/C20H15FO6/c1-8(22)20(27)7-12-11(6-13(20)21)18(25)14-15(19(12)26)17(24)10-5-3-2-4-9(10)16(14)23/h2-5,13,25-27H,6-7H2,1H3/t13-,20+/m0/s1
InChIKey SOMNBKPPFFWMGL-RNODOKPDSA-N
Molecular Weight 370.332 g/mol
SMILES Oc1c2c(c(c3c1C(c1c(C3=O)cccc1)=O)O)C[C@@]([C@@](C2)(C(=O)C)O)(F)[H]
SPLASH splash10-0pc0-0009000000-af706cc48d87acec678c
Source of Spectrum F-52-193-9
Synonyms (8R,9S)-8-acetyl-9-fluoro-6,8,11-trihydroxy-7,8,9,10-tetrahydro-5,12-naphthacenedione 2-Acetyl-2,5,12-trihydroxy-3-fluoronaphthacene-6,11-dione
Wiley ID 794616