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CHEBI:204073 - Halomadurone A

ChEBI IDCHEBI:204073
ChEBI NameHalomadurone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H13Cl3O2
Net Charge0
Average Mass307.604
Monoisotopic Mass305.99811
SMILESCC/C=C(C)/C=C/c1cc(=O)cc(C(Cl)(Cl)Cl)o1
InChIInChI=1S/C13H13Cl3O2/c1-3-4-9(2)5-6-11-7-10(17)8-12(18-11)13(14,15)16/h4-8H,3H2,1-2H3/b6-5+,9-4+
InChIKeyYCTUQKCBFWAVPW-BZNITXMSSA-N
Species of MetaboliteComponentSourceComments
Actinomaduraspecies (ncbitaxon:1989) - PubMed (24351907)
ChEBI Ontology
Outgoing Relation(s)
Halomadurone A (CHEBI:204073) is a pyranone (CHEBI:37963)
IUPAC Name 
2-[(1E,3E)-3-methylhexa-1,3-dienyl]-6-(trichloromethyl)pyran-4-one
Manual XrefsDatabases
30771391ChemSpider