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CHEBI:86300 - butamben picrate

ChEBI IDCHEBI:86300
ChEBI Namebutamben picrate
Stars
DefinitionAn organoammonium salt resulting from the formal reaction of butamben with 0.5 mol eq. of picric acid.
Last Modified2 July 2015
SubmitterGareth Owen
DownloadsMolfile
Formula2C11H15NO2.C6H3N3O7
Net Charge0
Average Mass615.596
Monoisotopic Mass615.21766
SMILESCCCCOC(=O)c1ccc(N)cc1.CCCCOC(=O)c1ccc(N)cc1.O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1
InChIInChI=1S/2C11H15NO2.C6H3N3O7/c2*1-2-3-8-14-11(13)9-4-6-10(12)7-5-9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2*4-7H,2-3,8,12H2,1H3;1-2,10H
InChIKeyATAGSVCDFKGYPE-UHFFFAOYSA-N
Roles Classification
Application:
local anaesthetic  Any member of a group of drugs that reversibly inhibit the propagation of signals along nerves. Wide variations in potency, stability, toxicity, water-solubility and duration of action determine the route used for administration, e.g. topical, intravenous, epidural or spinal block.
ChEBI Ontology
Outgoing Relation(s)
butamben picrate (CHEBI:86300) has part butamben (CHEBI:3231)
butamben picrate (CHEBI:86300) has part butamben(1+) (CHEBI:86302)
butamben picrate (CHEBI:86300) has part picrate anion (CHEBI:86297)
butamben picrate (CHEBI:86300) has role local anaesthetic (CHEBI:36333)
butamben picrate (CHEBI:86300) is a organoammonium salt (CHEBI:46850)
Synonyms  Source
butyl aminobenzoate picrateChEBI
butyl aminobenzoate hemipicrateChEBI
butyl 4-aminobenzoate hemipicrateChEBI
butamben hemipicrateChEBI
Abbott 34842ChEBI
butyl 4-aminobenzoate picrateChEBI
Manual XrefsDatabases
D03183KEGG DRUG
Registry NumbersSources
Reaxys:4930705Reaxys
CAS:577-48-0KEGG DRUG
CAS:577-48-0ChemIDplus
Citations