Preferred Name

O-desmethylvenlafaxine
Synonyms

4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

1-[2-(dimethylamino)-1-(4-hydroxyphenyl)ethyl]cyclohexanol

desvenlafaxine

Definitions

A tertiary amino compound that is N,N-dimethylethanamine substituted at position 1 by a 1-hydroxycyclohexyl and 4-hydroxyphenyl group. It is a metabolite of the drug venlafaxine.

ID

http://purl.obolibrary.org/obo/CHEBI_83527

alternative term

4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

1-[2-(dimethylamino)-1-(4-hydroxyphenyl)ethyl]cyclohexanol

desvenlafaxine

bearer of

http://purl.obolibrary.org/obo/CHEBI_49103

http://purl.obolibrary.org/obo/CHEBI_83399

http://purl.obolibrary.org/obo/CHEBI_35469

charge

0

database_cross_reference

PMID:25188033

Reaxys:4234613

PMID:25086830

Wikipedia:Desvenlafaxine

PMID:24502274

Drug_Central:4380

KEGG:D07793

PMID:24989434

HMDB:HMDB0015646

DrugBank:DB06700

CAS:93413-62-8

PMID:24493333

definition

A tertiary amino compound that is N,N-dimethylethanamine substituted at position 1 by a 1-hydroxycyclohexyl and 4-hydroxyphenyl group. It is a metabolite of the drug venlafaxine.

formula

C16H25NO2

has_obo_namespace

chebi_ontology

has_related_synonym

4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

1-[2-(dimethylamino)-1-(4-hydroxyphenyl)ethyl]cyclohexanol

desvenlafaxine

id

CHEBI:83527

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3

inchikey

KYYIDSXMWOZKMP-UHFFFAOYSA-N

label

O-desmethylvenlafaxine

mass

263.37520

monoisotopicmass

263.18853

notation

CHEBI:83527

prefLabel

O-desmethylvenlafaxine

RO_0000087

http://purl.obolibrary.org/obo/CHEBI_49103

http://purl.obolibrary.org/obo/CHEBI_83399

http://purl.obolibrary.org/obo/CHEBI_35469

smiles

CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1

subClassOf

http://purl.obolibrary.org/obo/CHEBI_33853

http://purl.obolibrary.org/obo/CHEBI_23480

http://purl.obolibrary.org/obo/CHEBI_50996

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