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Details

Stereochemistry ACHIRAL
Molecular Formula C14H17F3N2O3
Molecular Weight 318.2916
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of FLUVOXAMINE ACID

SMILES

NCCO\N=C(/CCCC(O)=O)C1=CC=C(C=C1)C(F)(F)F

InChI

InChIKey=KUIZEDQDELAFQK-XDHOZWIPSA-N
InChI=1S/C14H17F3N2O3/c15-14(16,17)11-6-4-10(5-7-11)12(19-22-9-8-18)2-1-3-13(20)21/h4-7H,1-3,8-9,18H2,(H,20,21)/b19-12+

HIDE SMILES / InChI
Fluvoxamino acid is a not pharmacologically active metabolite of fluvoxamine, drug, which used for the treatment of the obsessive compulsive disorder. The metabolism of fluvoxamine to fluvoxamino acid is involved a two-step oxidation process via an alcohol intermediate, fluvoxamino alcohol. CYP2D6 is responsible for the first-step oxidation of fluvoxamine to fluvoxamino alcohol, and alcohol dehydrogenase is involved in the second-step oxidation of fluvoxamino alcohol to the corresponding carbolic acid.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Identification of human cytochrome P450 enzymes involved in the major metabolic pathway of fluvoxamine.
2007 Feb

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Name Type Language
FLUVOXAMINE ACID
Common Name English
BENZENEPENTANOIC ACID, .DELTA.-((2-AMINOETHOXY)IMINO)-4-(TRIFLUOROMETHYL)-
Systematic Name English
Code System Code Type Description
CAS
84692-89-7
Created by admin on Sat Dec 16 08:49:57 GMT 2023 , Edited by admin on Sat Dec 16 08:49:57 GMT 2023
PRIMARY
FDA UNII
B92JLW9803
Created by admin on Sat Dec 16 08:49:57 GMT 2023 , Edited by admin on Sat Dec 16 08:49:57 GMT 2023
PRIMARY
PUBCHEM
46781630
Created by admin on Sat Dec 16 08:49:57 GMT 2023 , Edited by admin on Sat Dec 16 08:49:57 GMT 2023
PRIMARY