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CHEBI:203286 - Julichrome Q5.6

ChEBI IDCHEBI:203286
ChEBI NameJulichrome Q5.6
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SubmitterMetaboLights
DownloadsMolfile
FormulaC36H30O11
Net Charge0
Average Mass638.625
Monoisotopic Mass638.17881
SMILESCC(=O)OC(C)[C@@H]1c2cc3ccc(-c4ccc5c(c4O)C(=O)c4c(O)cc(C)c(C(C)=O)c4C5=O)c(O)c3c(O)c2C(=O)C[C@]1(C)O
InChIInChI=1S/C36H30O11/c1-13-10-22(39)28-29(24(13)14(2)37)33(43)20-9-8-19(32(42)27(20)35(28)45)18-7-6-17-11-21-26(34(44)25(17)31(18)41)23(40)12-36(5,46)30(21)15(3)47-16(4)38/h6-11,15,30,39,41-42,44,46H,12H2,1-5H3/t15?,30-,36+/m1/s1
InChIKeyBVTZYWKIAAZCNI-SRKKSHFISA-N
Species of MetaboliteComponentSourceComments
Streptomyces shiodaensis (ncbitaxon:285507) - DOI (10.1016/s0040-4020(01)98020-2)
ChEBI Ontology
Outgoing Relation(s)
Julichrome Q5.6 (CHEBI:203286) is a anthraquinone (CHEBI:22580)
IUPAC Name 
1-[(1S,2S)-6-(5-acetyl-1,8-dihydroxy-6-methyl-9,10-dioxoanthracen-2-yl)-2,5,10-trihydroxy-2-methyl-4-oxo-1,3-dihydroanthracen-1-yl]ethyl acetate
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