CHEBI:9943 - venlafaxine

ChEBI IDCHEBI:9943
ChEBI Namevenlafaxine
Stars
DefinitionA tertiary amino compound that is N,N-dimethylethanamine substituted at position 1 by a 1-hydroxycyclohexyl and 4-methoxyphenyl group.
Last Modified22 February 2017
DownloadsMolfile
FormulaC17H27NO2
Net Charge0
Average Mass277.408
Monoisotopic Mass277.20418
SMILESCOc1ccc(C(CN(C)C)C2(O)CCCCC2)cc1
InChIInChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3
InChIKeyPNVNVHUZROJLTJ-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 Roles:
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.
serotonin uptake inhibitor  A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.
adrenergic uptake inhibitor  Adrenergic uptake inhibitors are drugs that block the transport of adrenergic transmitters into axon terminals or into storage vesicles within terminals. The tricyclic antidepressants and amphetamines are among the therapeutically important drugs that may act via inhibition of adrenergic transport. Many of these drugs also block transport of serotonin.
dopamine uptake inhibitor  A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
Applications:
serotonin uptake inhibitor  A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.
adrenergic uptake inhibitor  Adrenergic uptake inhibitors are drugs that block the transport of adrenergic transmitters into axon terminals or into storage vesicles within terminals. The tricyclic antidepressants and amphetamines are among the therapeutically important drugs that may act via inhibition of adrenergic transport. Many of these drugs also block transport of serotonin.
dopamine uptake inhibitor  A dopaminergic agent that blocks the transport of dopamine into axon terminals or into storage vesicles within terminals. Most of the adrenergic uptake inhibitors also inhibit dopamine uptake.
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
venlafaxine (CHEBI:9943) has role adrenergic uptake inhibitor (CHEBI:35640)
venlafaxine (CHEBI:9943) has role analgesic (CHEBI:35480)
venlafaxine (CHEBI:9943) has role antidepressant (CHEBI:35469)
venlafaxine (CHEBI:9943) has role dopamine uptake inhibitor (CHEBI:51039)
venlafaxine (CHEBI:9943) has role environmental contaminant (CHEBI:78298)
venlafaxine (CHEBI:9943) has role serotonin uptake inhibitor (CHEBI:50949)
venlafaxine (CHEBI:9943) has role xenobiotic (CHEBI:35703)
venlafaxine (CHEBI:9943) is a cyclohexanols (CHEBI:23480)
venlafaxine (CHEBI:9943) is a monomethoxybenzene (CHEBI:25235)
venlafaxine (CHEBI:9943) is a tertiary alcohol (CHEBI:26878)
venlafaxine (CHEBI:9943) is a tertiary amino compound (CHEBI:50996)
Incoming Relation(s)
venlafaxine hydrochloride (CHEBI:9944) has part venlafaxine (CHEBI:9943)
IUPAC Name 
1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol
INNs  Source
venlafaxinaWHO MedNet
venlafaxineWHO MedNet
venlafaxineChemIDplus
venlafaxinumWHO MedNet
Synonyms  Source
ElafaxChemIDplus
VenlafaxineKEGG COMPOUND
Manual XrefsDatabases
2813DrugCentral
C07187KEGG COMPOUND
D08670KEGG DRUG
DB00285DrugBank
HMDB0005016HMDB
LSM-1616LINCS
VenlafaxineWikipedia
Registry NumbersSources
Reaxys:4234848Reaxys
CAS:93413-69-5KEGG COMPOUND
CAS:93413-69-5ChemIDplus
Citations