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CHEBI:135751 - tobuterol

Default Structure
ChEBI IDCHEBI:135751
ChEBI Nametobuterol
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC28H31NO5
Net Charge0
Average Mass461.558
Monoisotopic Mass461.22022
SMILESCc1ccc(C(=O)Oc2cc(OC(=O)c3ccc(C)cc3)cc(C(O)CNC(C)(C)C)c2)cc1
InChIInChI=1S/C28H31NO5/c1-18-6-10-20(11-7-18)26(31)33-23-14-22(25(30)17-29-28(3,4)5)15-24(16-23)34-27(32)21-12-8-19(2)9-13-21/h6-16,25,29-30H,17H2,1-5H3
InChIKeyGYJSIOWQEUTITA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
tobuterol (CHEBI:135751) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
2685DrugCentral
Registry NumbersSources
CAS:75626-99-2DrugCentral