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CHEBI:172317 - Anofinic acid

ChEBI IDCHEBI:172317
ChEBI NameAnofinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O3
Net Charge0
Average Mass204.225
Monoisotopic Mass204.07864
SMILESCC1(C)C=Cc2cc(C(=O)O)ccc2O1
InChIInChI=1S/C12H12O3/c1-12(2)6-5-8-7-9(11(13)14)3-4-10(8)15-12/h3-7H,1-2H3,(H,13,14)
InChIKeyAXICIBPYBONRSP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Anofinic acid (CHEBI:172317) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
2,2-dimethylchromene-6-carboxylic acid
Manual XrefsDatabases
4477586ChemSpider
HMDB0033303HMDB