CHEBI:167667 - garomefrine

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ChEBI Name garomefrine ChEBI ID CHEBI:167667 Definition A sulfonamide that is benzene substituted by (methylsulfonyl)amino, (1R)-2-amino-1-hydroxyethyl and fluoro groups at positions 1, 3 and 4, respectively. It is a selective agonist of α1A adrenoreceptor. Stars This entity has been manually annotated by the ChEBI Team. Submitter R. Stephan Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C9H13FN2O3S Net Charge 0 Average Mass 248.270 Monoisotopic Mass 248.06309 InChI InChI=1S/C9H13FN2O3S/c1-16(14,15)12-6-2-3-8(10)7(4-6)9(13)5-11/h2-4,9,12-13H,5,11H2,1H3/t9-/m0/s1 InChIKey XYLJNMCMDOOJRW-VIFPVBQESA-N SMILES CS(=O)(=O)NC1=CC([C@@H](O)CN)=C(F)C=C1 Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): alpha-adrenergic agonist An agent that selectively binds to and activates alpha-adrenergic receptors. Application(s): alpha-adrenergic agonist An agent that selectively binds to and activates alpha-adrenergic receptors. View more via ChEBI Ontology ChEBI Ontology Outgoing garomefrine (CHEBI:167667) has role α-adrenergic agonist (CHEBI:35569) garomefrine (CHEBI:167667) is a ethanolamines (CHEBI:23981) garomefrine (CHEBI:167667) is a monofluorobenzenes (CHEBI:83575) garomefrine (CHEBI:167667) is a primary amino compound (CHEBI:50994) garomefrine (CHEBI:167667) is a secondary alcohol (CHEBI:35681) garomefrine (CHEBI:167667) is a sulfonamide (CHEBI:35358) garomefrine (CHEBI:167667) is conjugate base of garomefrine(1+) (CHEBI:167679) Incoming garomefrine(1+) (CHEBI:167679) is conjugate acid of garomefrine (CHEBI:167667) IUPAC Name N-{3-[(1R)-2-amino-1-hydroxyethyl]-4-fluorophenyl}methanesulfonamide Synonyms Sources (−)-garomefrin ChemIDplus NS-49 (free base) ChEBI Manual Xref Database 8014483 ChemSpider View more database links Registry Number Type Source 137431-02-8 CAS Registry Number ChemIDplus Citations Types Sources 10367106 PubMed citation SUBMITTER 10425363 PubMed citation Europe PMC 10468772 PubMed citation Europe PMC 11413741 PubMed citation Europe PMC 15100386 PubMed citation Europe PMC 8719417 PubMed citation SUBMITTER 9007522 PubMed citation Europe PMC Last Modified 15 March 2021