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CHEBI:199030 - Phenatic acid B

ChEBI IDCHEBI:199030
ChEBI NamePhenatic acid B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O6
Net Charge0
Average Mass292.287
Monoisotopic Mass292.09469
SMILESCc1cc(C)c(O)c(C(=O)C2OC(=O)CC2CC(=O)O)c1
InChIInChI=1S/C15H16O6/c1-7-3-8(2)13(19)10(4-7)14(20)15-9(5-11(16)17)6-12(18)21-15/h3-4,9,15,19H,5-6H2,1-2H3,(H,16,17)
InChIKeyXMMWCOYSUBFDCF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1038/ja.2005.29)
ChEBI Ontology
Outgoing Relation(s)
Phenatic acid B (CHEBI:199030) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
2-[2-(2-hydroxy-3,5-dimethylbenzoyl)-5-oxooxolan-3-yl]acetic acid
Manual XrefsDatabases
9646699ChemSpider