CHEBI:83525 - N-desmethylvenlafaxine

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ChEBI Name N-desmethylvenlafaxine
ChEBI ID CHEBI:83525
ChEBI ASCII Name N-desmethylvenlafaxine
Definition A monomethoxybenzene that is the N-desmethyl derivative of venlafaxine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C16H25NO2
Net Charge 0
Average Mass 263.37520
Monoisotopic Mass 263.18853
InChI InChI=1S/C16H25NO2/c1-17-12-15(16(18)10-4-3-5-11-16)13-6-8-14(19-2)9-7-13/h6-9,15,17-18H,3-5,10-12H2,1-2H3
InChIKey MKAFOJAJJMUXLW-UHFFFAOYSA-N
SMILES CNCC(c1ccc(OC)cc1)C1(O)CCCCC1
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): drug metabolite

marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-desmethylvenlafaxine (CHEBI:83525) has role drug metabolite (CHEBI:49103)
N-desmethylvenlafaxine (CHEBI:83525) has role marine xenobiotic metabolite (CHEBI:83399)
N-desmethylvenlafaxine (CHEBI:83525) is a cyclohexanols (CHEBI:23480)
N-desmethylvenlafaxine (CHEBI:83525) is a monomethoxybenzene (CHEBI:25235)
N-desmethylvenlafaxine (CHEBI:83525) is a secondary amino compound (CHEBI:50995)
IUPAC Name
1-[1-(4-methoxyphenyl)-2-(methylamino)ethyl]cyclohexanol
Synonym Source
Norvenlafaxine ChemIDplus
Registry Numbers Types Sources
149289-30-5 CAS Registry Number ChemIDplus
4234609 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
20432045 PubMed citation Europe PMC
24306328 PubMed citation Europe PMC
25245581 PubMed citation Europe PMC
Last Modified
18 November 2014