CHEBI:198522 - N-butyl asterrate

ChEBI IDCHEBI:198522
ChEBI NameN-butyl asterrate
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FormulaC21H24O8
Net Charge0
Average Mass404.415
Monoisotopic Mass404.14712
SMILESCCCCOC(=O)c1c(O)cc(C)cc1Oc1c(OC)cc(O)cc1C(=O)OC
InChIInChI=1S/C21H24O8/c1-5-6-7-28-21(25)18-15(23)8-12(2)9-16(18)29-19-14(20(24)27-4)10-13(22)11-17(19)26-3/h8-11,22-23H,5-7H2,1-4H3
InChIKeyAMBZQPZFNBPPTD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Geomycesspecies (ncbitaxon:1715258) - PubMed (18720971)
ChEBI Ontology
Outgoing Relation(s)
N-butyl asterrate (CHEBI:198522) is a aromatic ether (CHEBI:35618)
IUPAC Name 
butyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate
Manual XrefsDatabases
24707900ChemSpider