N-DESMETHYLVENLAFAXINE

Details

Stereochemistry	RACEMIC
Molecular Formula	C16H25NO2
Molecular Weight	263.3752
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CNCC(C1=CC=C(OC)C=C1)C2(O)CCCCC2

InChI

InChIKey=MKAFOJAJJMUXLW-UHFFFAOYSA-N

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

HIDE SMILES / InChI

Molecular Formula	C16H25NO2
Molecular Weight	263.3752
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Norepinephrine transporter 191 Target ID: CHEMBL222 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1976813	Inhibitor 8297		4700.0 nM [IC50]
Serotonin transporter 178 Target ID: CHEMBL228 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1976813	Inhibitor 8297		1600.0 nM [IC50]

PubMed

Title	Date	PubMed
Influence of CYP2D6 genotype on the disposition of the enantiomers of venlafaxine and its major metabolites in postmortem femoral blood.	2012 Jan 10	21840145

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:32:09 GMT 2023` Edited by `admin` on `Sat Dec 16 05:32:09 GMT 2023`
Record UNII	19V5EX4E8B
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

N-DESMETHYLVENLAFAXINE

Common Name

English

VENLAFAXINE RELATED COMPOUND A [USP IMPURITY]

Common Name

English

CYCLOHEXANOL, 1-(1-(4-METHOXYPHENYL)-2-(METHYLAMINO)ETHYL)-

Systematic Name

English

VENLAFAXINE HYDROCHLORIDE IMPURITY D [EP IMPURITY]

Common Name

English

VENLAFAXINE RELATED COMPOUND A [USP-RS]

Common Name

English

NORVENLAFAXINE

Common Name

English

1-((1RS)-1-(4-METHOXYPHENYL)-2-(METHYLAMINO)ETHYL)CYCLOHEXANOL

Systematic Name

English

VENLAFAXINE RELATED COMPOUND A

Common Name

English

Code System Code Type Description

RS_ITEM_NUM

1711279