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CHEBI:135336 - ibuprofen guaiacol ester

ChEBI IDCHEBI:135336
ChEBI Nameibuprofen guaiacol ester
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC20H24O3
Net Charge0
Average Mass312.409
Monoisotopic Mass312.17254
SMILESCOc1ccccc1OC(=O)C(C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C20H24O3/c1-14(2)13-16-9-11-17(12-10-16)15(3)20(21)23-19-8-6-5-7-18(19)22-4/h5-12,14-15H,13H2,1-4H3
InChIKeyFVRWRGBTEHAPDI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ibuprofen guaiacol ester (CHEBI:135336) is a monoterpenoid (CHEBI:25409)
Synonyms  Source
metoxibutropateDrugCentral
methoxybutropateDrugCentral
Manual XrefsDatabases
1410DrugCentral
Registry NumbersSources
CAS:66332-77-2DrugCentral