BOXIDINE HYDROCHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H20F3NO.ClH
Molecular Weight	371.824
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.FC(F)(F)C1=CC=C(C=C1)C2=CC=C(OCCN3CCCC3)C=C2

InChI

InChIKey=WQIGUMCAPSUZKW-UHFFFAOYSA-N

InChI=1S/C19H20F3NO.ClH/c20-19(21,22)17-7-3-15(4-8-17)16-5-9-18(10-6-16)24-14-13-23-11-1-2-12-23;/h3-10H,1-2,11-14H2;1H

HIDE SMILES / InChI

Molecular Formula	C19H20F3NO
Molecular Weight	335.3634
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/28642035

Boxidine (1-[2-[[4′-(Trifluoromethyl)-4-biphenylyl]oxy]ethyl]pyrrolidine) is an inhibitor of 3β-hydroxysteroid-Δ7-reductase (DHCR7) thereby it affects cholesterol biosynthesis. Boxidine induces the accumulation of desmosterol.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:11:24 GMT 2023` Edited by `admin` on `Fri Dec 15 15:11:24 GMT 2023`
Record UNII	3L4BF478JK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BOXIDINE HYDROCHLORIDE

Common Name

English

PYRROLIDINE, 1-(2-((4'-(TRIFLUOROMETHYL)(1,1'-BIPHENYL)-4-YL)OXY)ETHYL)-, HYDROCHLORIDE

Systematic Name

English

NSC-146266

Code

English

PYRROLIDINE, 1-(2-((4'-(TRIFLUOROMETHYL)-4-BIPHENYLYL)OXY)ETHYL)-, HYDROCHLORIDE

Systematic Name

English

1-(2-((4'-(TRIFLUOROMETHYL)-4-BIPHENYLYL)OXY)ETHYL)PYRROLIDINE, HYDROCHLORIDE

Systematic Name

English

BOXIDINE HCL

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29703