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CHEBI:81003 - AL-294

ChEBI IDCHEBI:81003
ChEBI NameAL-294
Stars
DownloadsMolfile
FormulaC21H25ClO3
Net Charge0
Average Mass360.881
Monoisotopic Mass360.14922
SMILESCCOC(=O)C(Cl)Cc1ccc(OCC(C)(C)c2ccccc2)cc1
InChIInChI=1S/C21H25ClO3/c1-4-24-20(23)19(22)14-16-10-12-18(13-11-16)25-15-21(2,3)17-8-6-5-7-9-17/h5-13,19H,4,14-15H2,1-3H3
InChIKeyKIZXRDIROMPMKU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
AL-294 (CHEBI:81003) is a alkylbenzene (CHEBI:38976)
Synonym  Source
Ethyl 2-chloro-3-(4-(2-methyl-2-phenylpropoxy)phenyl)propanoateKEGG COMPOUND
Manual XrefsDatabases
C17302KEGG COMPOUND
Registry NumbersSources
CAS:62516-91-0KEGG COMPOUND