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CHEBI:230566 - romazarit

Default Structure
ChEBI IDCHEBI:230566
ChEBI Nameromazarit
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16ClNO4
Net Charge0
Average Mass309.749
Monoisotopic Mass309.07679
SMILESCc1nc(-c2ccc(Cl)cc2)oc1COC(C)(C)C(=O)O
InChIInChI=1S/C15H16ClNO4/c1-9-12(8-20-15(2,3)14(18)19)21-13(17-9)10-4-6-11(16)7-5-10/h4-7H,8H2,1-3H3,(H,18,19)
InChIKeyLNXXSBRGLBOASF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
romazarit (CHEBI:230566) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
2-[[2-(4-chlorophenyl)-4-methyl-1,3-oxazol-5-yl]methoxy]-2-methylpropanoic acid
Manual XrefsDatabases
64429ChemSpider
D05751KEGG DRUG
HMDB0257296HMDB