CHEBI:135502 - tinofedrine

ChEBI IDCHEBI:135502
ChEBI Nametinofedrine
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Last Modified23 February 2017
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FormulaC20H21NOS2
Net Charge0
Average Mass355.528
Monoisotopic Mass355.10646
SMILESC[C@H](NCC=C(c1ccsc1)c1ccsc1)[C@H](O)c1ccccc1
InChIInChI=1S/C20H21NOS2/c1-15(20(22)16-5-3-2-4-6-16)21-10-7-19(17-8-11-23-13-17)18-9-12-24-14-18/h2-9,11-15,20-22H,10H2,1H3/t15-,20-/m0/s1
InChIKeyJQSHEDRVRBSFCZ-YWZLYKJASA-N
ChEBI Ontology
Outgoing Relation(s)
tinofedrine (CHEBI:135502) is a alkylbenzene (CHEBI:38976)
Manual XrefsDatabases
3843DrugCentral
Registry NumbersSources
CAS:66788-41-8DrugCentral