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CHEBI:210355 - Spiromastol A

ChEBI IDCHEBI:210355
ChEBI NameSpiromastol A
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SubmitterMetaboLights
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FormulaC18H19Cl3O4
Net Charge0
Average Mass405.705
Monoisotopic Mass404.03489
SMILESCCCc1cc(Oc2c(O)cc(O)c(Cl)c2CCC)c(Cl)c(O)c1Cl
InChIInChI=1S/C18H19Cl3O4/c1-3-5-9-7-13(16(21)17(24)14(9)19)25-18-10(6-4-2)15(20)11(22)8-12(18)23/h7-8,22-24H,3-6H2,1-2H3
InChIKeyIAXYDKDNACGYIT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Spiromastigoides (ncbitaxon:37234) - PubMed (25913707)
ChEBI Ontology
Outgoing Relation(s)
Spiromastol A (CHEBI:210355) is a aromatic ether (CHEBI:35618)
IUPAC Name 
4-chloro-6-(2,4-dichloro-3-hydroxy-5-propylphenoxy)-5-propylbenzene-1,3-diol
Manual XrefsDatabases
35516939ChemSpider