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CHEBI:216917 - Apteniol A

ChEBI IDCHEBI:216917
ChEBI NameApteniol A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H18O5
Net Charge0
Average Mass314.337
Monoisotopic Mass314.11542
SMILESO=C(O)CCc1ccc(Oc2ccc(CCC(=O)O)cc2)cc1
InChIInChI=1S/C18H18O5/c19-17(20)11-5-13-1-7-15(8-2-13)23-16-9-3-14(4-10-16)6-12-18(21)22/h1-4,7-10H,5-6,11-12H2,(H,19,20)(H,21,22)
InChIKeyUKCHMOVWJBXLBX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - PubMed (20479975)
ChEBI Ontology
Outgoing Relation(s)
Apteniol A (CHEBI:216917) is a aromatic ether (CHEBI:35618)
IUPAC Name 
3-[4-[4-(2-carboxyethyl)phenoxy]phenyl]propanoic acid
Manual XrefsDatabases
9820071ChemSpider