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CHEBI:224534 - (1'S)-7-chloroaverantin

ChEBI IDCHEBI:224534
ChEBI Name(1'S)-7-chloroaverantin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H19ClO7
Net Charge0
Average Mass406.818
Monoisotopic Mass406.08193
SMILESCCCCC[C@H](O)c1c(O)cc2c(c1O)C(=O)c1c(cc(O)c(Cl)c1O)C2=O
InChIInChI=1S/C20H19ClO7/c1-2-3-4-5-10(22)15-11(23)6-8-13(19(15)27)18(26)14-9(17(8)25)7-12(24)16(21)20(14)28/h6-7,10,22-24,27-28H,2-5H2,1H3/t10-/m0/s1
InChIKeyHNRVQTSTGMYTJQ-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies SCSIO F063 (ncbitaxon:1166486) - PubMed (22703109)
ChEBI Ontology
Outgoing Relation(s)
(1'S)-7-chloroaverantin (CHEBI:224534) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2-chloro-1,3,6,8-tetrahydroxy-7-[(1S)-1-hydroxyhexyl]anthracene-9,10-dione
Manual XrefsDatabases
28515495ChemSpider