LUMACAFTOR

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H18F2N2O5
Molecular Weight	452.4069
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of LUMACAFTOR

Structure Search

SMILES

CC1=CC=C(NC(=O)C2(CC2)C3=CC4=C(OC(F)(F)O4)C=C3)N=C1C5=CC=CC(=C5)C(O)=O

InChI

InChIKey=UFSKUSARDNFIRC-UHFFFAOYSA-N

InChI=1S/C24H18F2N2O5/c1-13-5-8-19(27-20(13)14-3-2-4-15(11-14)21(29)30)28-22(31)23(9-10-23)16-6-7-17-18(12-16)33-24(25,26)32-17/h2-8,11-12H,9-10H2,1H3,(H,29,30)(H,27,28,31)

HIDE SMILES / InChI

Molecular Formula	C24H18F2N2O5
Molecular Weight	452.4069
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:15:38 UTC 2023` Edited by `admin` on `Fri Dec 15 20:15:38 UTC 2023`
Record UNII	EGP8L81APK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

LUMACAFTOR

Official Name

English

LUMACAFTOR [ORANGE BOOK]

Common Name

English

VRT826809

Code

English

VX-809

Code

English

VRT-826809

Code

English

Lumacaftor [WHO-DD]

Common Name

English

LUMACAFTOR [MI]

Common Name

English

VX809

Code

English

3-(6-(1-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)CYCLOPROPANE-1-CARBOXAMIDO)-3-METHYLPYRIDIN-2-YL)BENZOIC ACID

Systematic Name

English

ORKAMBI COMPONENT LUMACAFTOR

Brand Name

English

BENZOIC ACID, 3-(6-(((1-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)CYCLOPROPYL)CARBONYL)AMINO)-3-METHYL-2-PYRIDINYL)-

Common Name

English

3-(6-(1-(2,2-DIFLUOROBENZO(D) (1,3)DIOXYL-5-YL)CYCLOPROPANECARBOXAMIDO)-3-METHYLPYRIDIN-2-YL)BENZOIC ACID

Systematic Name

English

lumacaftor [INN]

Common Name

English

LUMACAFTOR COMPONENT OF ORKAMBI

Brand Name

English

LUMACAFTOR [USAN]

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

301610

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

EMA ASSESSMENT REPORTS

ORKAMBI (AUTHORIZED: CYSTIC FIBROSIS)

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

FDA ORPHAN DRUG

434814

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

EU-Orphan Drug

EU/3/14/1333

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

FDA ORPHAN DRUG

761720

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

WHO-ATC

R07AX30

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

Code System Code Type Description

CAS

936727-05-8

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000184145

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Chloride Channel Activation Potentiators [MoA]

FDA UNII

EGP8L81APK

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

ChEMBL

CHEMBL2103870

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

DRUG CENTRAL

5010

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

USAN

XX-134

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

DRUG BANK

DB09280

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000187063

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2C8 Inducers [MoA]

NDF-RT

N0000187064

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2B6 Inducers [MoA]

WIKIPEDIA

LUMACAFTOR

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

IUPHAR

7481

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000185504

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2C9 Inhibitors [MoA]

NDF-RT

N0000185607

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2C19 Inducers [MoA]

INN

9449

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

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MERCK INDEX

m11859

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000190118

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 3A Inducers [MoA]

RXCUI

1655922

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

RxNorm

EVMPD

SUB130518

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000185507

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2C9 Inducers [MoA]

CHEBI

90951

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

DAILYMED

EGP8L81APK

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

LACTMED

Lumacaftor and Ivacaftor

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

PUBCHEM

16678941

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

EPA CompTox

DTXSID30239523

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

NDF-RT

N0000187062

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Cytochrome P450 2C8 Inhibitors [MoA]

NCI_THESAURUS

C170136

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

SMS_ID

100000156577

Created by admin on Fri Dec 15 20:15:38 UTC 2023 , Edited by admin on Fri Dec 15 20:15:38 UTC 2023

PRIMARY

Related Record Type Details


					PUO0521HZV

CYTOCHROME P450 3A4

METABOLIC ENZYME -> INDUCER

Comments:

Lumacaftor is a strong inducers of CYP3A4

Amount:


					0189J4XE1H

CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR F508 DELETED

TARGET->CORRECTOR

Comments:

Acts as a chaperone during protein folding and increases the number of CFTR proteins that are trafficked to the cell surface.[

Amount:

Related Record Type Details


					EGP8L81APK

ACTIVE MOIETY

Amount: