CHEBI:9738 - trimipramine

ChEBI IDCHEBI:9738
ChEBI Nametrimipramine
Stars
DefinitionA dibenzoazepine that is 10,11-dihydro-5H-dibenzo[b,f]azepine substituted by a 3-(dimethylamino)-2-methylpropyl group at the nitrogen atom. It is used as an antidepressant.
Last Modified22 February 2017
DownloadsMolfile
FormulaC20H26N2
Net Charge0
Average Mass294.442
Monoisotopic Mass294.20960
SMILESCC(CN(C)C)CN1c2ccccc2CCc2ccccc21
InChIInChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3
InChIKeyZSCDBOWYZJWBIY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application:
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
trimipramine (CHEBI:9738) has functional parent imipramine (CHEBI:47499)
trimipramine (CHEBI:9738) has role antidepressant (CHEBI:35469)
trimipramine (CHEBI:9738) has role environmental contaminant (CHEBI:78298)
trimipramine (CHEBI:9738) has role xenobiotic (CHEBI:35703)
trimipramine (CHEBI:9738) is a dibenzoazepine (CHEBI:47804)
trimipramine (CHEBI:9738) is a tertiary amino compound (CHEBI:50996)
Incoming Relation(s)
trimipramine maleate (CHEBI:35030) has part trimipramine (CHEBI:9738)
IUPAC Name 
3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N,2-trimethylpropan-1-amine
Synonyms  Source
10,11-dihydro-N,N,β-trimethyl-5H-dibenz[b,f]azepine-5-propanamineNIST Chemistry WebBook
5-[3-(dimethylamino)-2-methylpropyl]-10,11-dihydro-5H-dibenz[b,f]azepineNIST Chemistry WebBook
5-(γ-dimethylamino-β-methylpropyl)-10,11-dihydro-5H-dibenzo[b,f]azepineNIST Chemistry WebBook
RP-7162NIST Chemistry WebBook
TrimipramineChemIDplus
TrimeprimineChemIDplus
Manual XrefsDatabases
D00394KEGG DRUG
TrimipramineWikipedia
DB00726DrugBank
HMDB0014864HMDB
CN103893187Patent
LSM-1371LINCS
2758DrugCentral
Registry NumbersSources
Reaxys:1321466Reaxys
CAS:739-71-9NIST Chemistry WebBook
CAS:739-71-9ChemIDplus
Citations