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CHEBI:212638 - (1'S)-7-chloroaverantin-1'-butyl ether

ChEBI IDCHEBI:212638
ChEBI Name(1'S)-7-chloroaverantin-1'-butyl ether
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FormulaC24H27ClO7
Net Charge0
Average Mass462.926
Monoisotopic Mass462.14453
SMILESCCCCC[C@H](OCCCC)c1c(O)cc2c(c1O)C(=O)c1c(cc(O)c(Cl)c1O)C2=O
InChIInChI=1S/C24H27ClO7/c1-3-5-7-8-16(32-9-6-4-2)19-14(26)10-12-17(23(19)30)22(29)18-13(21(12)28)11-15(27)20(25)24(18)31/h10-11,16,26-27,30-31H,3-9H2,1-2H3/t16-/m0/s1
InChIKeyRUYISUBUASQYBJ-INIZCTEOSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies SCSIO F063 (ncbitaxon:1166486) - PubMed (22703109)
ChEBI Ontology
Outgoing Relation(s)
(1'S)-7-chloroaverantin-1'-butyl ether (CHEBI:212638) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2-[(1S)-1-butoxyhexyl]-7-chloro-1,3,6,8-tetrahydroxyanthracene-9,10-dione
Manual XrefsDatabases
28515199ChemSpider