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(+/-)-HATOMARUBIGIN-C;(+/-)-1,11-DIHYDROXY-8-METHOXY-3-METHYL-1,2,3,4-TETRAHYDROBENZO-[A]-ANTHRACENE-7,12-DIONE
SpectraBase Compound ID D2z4uChReyH
InChI InChI=1S/C20H18O5/c1-9-7-10-3-4-11-16(15(10)13(22)8-9)20(24)17-12(21)5-6-14(25-2)18(17)19(11)23/h3-6,9,13,21-22H,7-8H2,1-2H3/t9-,13-/m0/s1
InChIKey CAEGIOZCLWNLAP-ZANVPECISA-N
Mol Weight 338.36 g/mol
Molecular Formula C20H18O5
Exact Mass 338.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbNgHcwb3k0
Name (1S,3S)-1,11-dihydroxy-8-methoxy-3-methyl-1,2,3,4-tetrahydrobenzo[a]anthracene-7,12-dione
Alternate Name(s) (1S,3S)-1,11-dihydroxy-8-methoxy-3-methyl-1,2,3,4-tetrahydrobenz[a]anthracene-7,12-quinone (1S,3S)-8-methoxy-3-methyl-1,11-bis(oxidanyl)-1,2,3,4-tetrahydrobenzo[a]anthracene-7,12-dione Hatomarubigin C
Comments Less than 3 mono-isotopic peaks
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Formula C20H18O5
InChI InChI=1S/C20H18O5/c1-9-7-10-3-4-11-16(15(10)13(22)8-9)20(24)17-12(21)5-6-14(25-2)18(17)19(11)23/h3-6,9,13,21-22H,7-8H2,1-2H3/t9-,13-/m0/s1
InChIKey CAEGIOZCLWNLAP-ZANVPECISA-N
Molecular Weight 338.359 g/mol
SMILES O[C@]1(C[C@](Cc2c1c1c(C(c3c(c(ccc3OC)O)C1=O)=O)cc2)(C)[H])[H]
SPLASH splash10-00dr-0009000000-ba5d570ef082fda91ecd
Source of Spectrum JA-50-301-0
Wiley ID 1333846