CHEBI:31685 - Ibuprofen piconol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Ibuprofen piconol
ChEBI ID CHEBI:31685
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C19H23NO2
C19H23NO2
Net Charge 0
Average Mass 297.392
Monoisotopic Mass 297.17288
InChI InChI=1S/C19H23NO2/c1-14(2)12-16-7-9-17(10-8-16)15(3)19(21)22-13-18-6-4-5-11-20-18/h4-11,14-15H,12-13H2,1-3H3
InChIKey ACEWLPOYLGNNHV-UHFFFAOYSA-N
SMILES C(C(OCC1=CC=CC=N1)=O)(C)C2=CC=C(C=C2)CC(C)C
ChEBI Ontology
Outgoing Ibuprofen piconol (CHEBI:31685) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
Ibuprofen piconol KEGG COMPOUND
pimeprofen DrugCentral
staderm DrugCentral
Manual Xrefs Databases
1409 DrugCentral
D01122 KEGG DRUG
View more database links
Registry Numbers Types Sources
112017-99-9 CAS Registry Number KEGG COMPOUND
64622-45-3 CAS Registry Number DrugCentral
Last Modified
22 February 2017