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Hatomarubigin A
SpectraBase Compound ID D5TYnuXtkL6
InChI InChI=1S/C20H16O5/c1-9-6-10-8-13(22)17-18(15(10)12(21)7-9)19(23)11-4-3-5-14(25-2)16(11)20(17)24/h3-5,8-9,22H,6-7H2,1-2H3
InChIKey INDHOTAYTXVPSZ-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeGT8r4EUtT
Name Hatomarubigin A
Alternate Name(s) 6-Hydroxy-8-methoxy-3-methyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione 8-Methoxy-3-methyl-6-oxidanyl-3,4-dihydro-2H-benzo[a]anthracene-1,7,12-trione
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Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-9-6-10-8-13(22)17-18(15(10)12(21)7-9)19(23)11-4-3-5-14(25-2)16(11)20(17)24/h3-5,8-9,22H,6-7H2,1-2H3
InChIKey INDHOTAYTXVPSZ-UHFFFAOYSA-N
Molecular Weight 336.343 g/mol
SMILES Oc1c2c(C(=O)c3c(C2=O)c(OC)ccc3)c2C(CC(Cc2c1)C)=O
SPLASH splash10-000f-0398000000-7ac621d1ce19b07a22d7
Source of Spectrum F-56-10252-2
Wiley ID 859480