CHEBI:32288 - Valethamate bromide

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ChEBI Name Valethamate bromide ChEBI ID CHEBI:32288 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formulae C19H32BrNO2 C19H32NO2.Br Net Charge 0 Average Mass 386.367 Monoisotopic Mass 385.16164 InChI InChI=1S/C19H32NO2.BrH/c1-6-16(4)18(17-12-10-9-11-13-17)19(21)22-15-14-20(5,7-2)8-3;/h9-13,16,18H,6-8,14-15H2,1-5H3;1H/q+1;/p-1 InChIKey CEJGGHKJHDHLAZ-UHFFFAOYSA-M SMILES [Br-].CC[N+](CCOC(C(C1=CC=CC=C1)C(C)CC)=O)(CC)C ChEBI Ontology Outgoing Valethamate bromide (CHEBI:32288) is a alkylbenzene (CHEBI:38976) Synonyms Sources Shinmetane (TN) KEGG COMPOUND Valethamate bromide KEGG COMPOUND Manual Xref Database D01538 KEGG DRUG View more database links Registry Number Type Source 90-22-2 CAS Registry Number KEGG COMPOUND Last Modified 06 March 2017