Terminology Service for NFDI4Health
butamben picrate
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http://purl.obolibrary.org/obo/CHEBI_86300
An organoammonium salt resulting from the formal reaction of butamben with 0.5 mol eq. of picric acid.
Term info
Label
butamben picrate
Subsets
3_STAR
charge
0
formula
C28H33N5O11
has obo namespace
chebi_ontology
has related synonym
butyl 4-aminobenzoate hemipicrate, butyl aminobenzoate hemipicrate, butyl p-aminobenzoate, picrate (2:1), butamben hemipicrate, butyl aminobenzoate picrate, Abbott-34842, butyl 4-aminobenzoate picrate, Abbott 34842
id
CHEBI:86300
inchi
InChI=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
inchikey
ATAGSVCDFKGYPE-UHFFFAOYSA-N
mass
615.58850
monoisotopicmass
615.21766
smiles
CCCCOC(=O)c1ccc(N)cc1.CCCCOC(=O)c1ccc(N)cc1.Oc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O
Term relations
Subclass of:
- organoammonium salt
- has part some butamben
- has part some picrate anion
- has role some local anaesthetic
- has part some butamben(1+)