efavirenz (Q422645)

From Wikidata

Jump to navigation Jump to search

The printable version is no longer supported and may have rendering errors. Please update your browser bookmarks and please use the default browser print function instead.

chemical compound

(S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one
(-)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one
(S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one
6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one

Language	Label	Description	Also known as
English	efavirenz	chemical compound	(S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one (-)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one (S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one 6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one

Statements

type of chemical entity

0 references

unsaturated compound

0 references

1 reference

Efavirenz (English)

language of work or name

publication date

17 November 2015

chemical structure

Efavirenz skeletal.svg
450 × 505; 2 KB

0 references

315.027 dalton

1 reference

language of work or name

efavirenz (English)

18 November 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₁₄H₉ClF₃NO₂

1 reference

language of work or name

efavirenz (English)

18 November 2016

canonical SMILES

C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

1 reference

language of work or name

efavirenz (English)

18 November 2016

isomeric SMILES

C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

1 reference

language of work or name

efavirenz (English)

18 November 2016

defined daily dose

0.6 gram

route of administration

oral administration

1 reference

https://www.whocc.no/atc_ddd_index/?code=J05AG03

active ingredient in

1 reference

European Medicines Agency product number

EMEA/H/C/002352

http://www.ema.europa.eu/ema/index.jsp?curl=pages/medicines/human/medicines/002352/human_med_001530.jsp

22 March 2017

1 reference

European Medicines Agency product number

EMEA/H/C/000250

http://www.ema.europa.eu/ema/index.jsp?curl=pages/medicines/human/medicines/000250/human_med_001066.jsp

22 March 2017

1 reference

14 February 2018

World Health Organisation international non-proprietary name

efavirenz (English)

1 reference

language of work or name

Efavirenz (English)

19 January 2016

Penicillium griseofulvum

1 reference

Griseofulvin Derivative and Indole Alkaloids from Penicillium griseofulvum CPCC 400528.

Stachybotrys chartarum

2 references

Stachybotrysins A-G, Phenylspirodrimane Derivatives from the Fungus Stachybotrys chartarum.

Phenylspirodrimanes with anti-HIV activity from the sponge-derived fungus Stachybotrys chartarum MXH-X73.

1 reference

Metabolites from the Plant Endophytic Fungus Aspergillus sp. CPCC 400735 and Their Anti-HIV Activities.

medical condition treated

2 references

language of work or name

13 December 2016

Drug Indications Extracted from FAERS

2 October 2018

human immunodeficiency virus infectious disease

1 reference

language of work or name

13 December 2016

human immunodeficiency virus infectious disease

16 September 1998

Food and Drug Administration

1 reference

Inxight: Drugs Database

2 November 2018

https://drugs.ncats.io/drug/JE6H2O27P8

http://www.accessdata.fda.gov/drugsatfda_docs/label/2011/020972s038lbl.pdf

significant drug interaction

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

Achor-Smith syndrom

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

decreased international normalised ratio

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

increased international normalised ratio

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

long QT syndrome

1 reference

sourcing circumstances

A reference set of clinically relevant adverse drug-drug interactions

pregnancy category

US pregnancy category D

1 reference

imported from Wikimedia project

English Wikipedia

LiverTox likelihood score

LiverTox toxicity likelihood category A

1 reference

8 April 2021

https://www.ncbi.nlm.nih.gov/books/n/livertox/Efavirenz

10 February 2018

subject has role

reverse-transcriptase inhibitor

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

cytochrome P-450 CYP2C9 Inhibitor

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

cytochrome P-450 CYP3A inducers

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

cytochrome P-450 CYP2C19 Inhibitors

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

cytochrome P-450 CYP2B6 Inducers

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

2 references

Non-Nucleoside Analog

1 reference

27 February 2018

essential medicine

0 references

Commons category

Efavirenz

0 references

CAS COVID-19 Anti-Viral Candidate Compounds

0 references

Identifiers

InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1

1 reference

language of work or name

efavirenz (English)

18 November 2016

XPOQHMRABVBWPR-ZDUSSCGKSA-N

2 references

language of work or name

efavirenz (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

efavirenz (English)

18 November 2016

CAS Common Chemistry

7 April 2021

https://commonchemistry.cas.org/detail?cas_rn=154598-52-4

XPOQHMRABVBWPR-ZDUSSCGKSA-N

1 reference

language of work or name

Efavirenz (English)

18 November 2016

2 references

language of work or name

efavirenz (English)

18 November 2016

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

Reaxys registry number

7387333

1 reference

language of work or name

efavirenz (English)

19 October 2016

mapping relation type

3 references

language of work or name

EFAVIRENZ (English)

18 November 2016

ChEBI release 2019-10-02

matched by identifier from

International Chemical Identifier

InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1

1 reference

language of work or name

EFAVIRENZ (English)

18 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

UniChem compound ID

1 reference

MassBank accession ID

0 references

0 references

MSBNK-Eawag-EQ329201

0 references

MSBNK-Eawag-EQ329202

0 references

MSBNK-Eawag-EQ329203

0 references

MSBNK-Eawag-EQ329204

0 references

MSBNK-Eawag-EQ329205

0 references

MSBNK-Eawag-EQ329206

0 references

MSBNK-Eawag-EQ329251

0 references

MSBNK-Eawag-EQ329252

0 references

MSBNK-Eawag-EQ329253

0 references

MSBNK-Eawag-EQ329254

0 references

MSBNK-Eawag-EQ329255

0 references

MSBNK-Eawag-EQ329256

0 references

MSBNK-Waters-WA000367

0 references

MSBNK-Waters-WA000368

0 references

MSBNK-Waters-WA000369

0 references

MSBNK-Waters-WA000370

0 references

MSBNK-Waters-WA000371

0 references

MSBNK-Waters-WA000372

0 references

MSBNK-Waters-WA000373

0 references

splash10-0frx-0190000000-deeefb25f97b767955b2

0 references

splash10-0giu-0390000000-7a682b484377bc11de1b

0 references

splash10-01b9-0790000000-a789e578dcf6568d7eb9

0 references

splash10-014i-0930000000-a1dae29a53e6be48d87f

0 references

splash10-014r-0910000000-70a86e64f2e50ce28b18

0 references

splash10-03di-1059000000-f599b397bafd1974176e

0 references

splash10-014l-5090000000-b807e6fcee57f8b27cb6

0 references

splash10-014i-9040000000-260d9ba8c55987cd2b0e

0 references

splash10-014i-9010000000-459e48522e8275e941f8

0 references

splash10-014i-9000000000-531ef8f962aff7837863

0 references

splash10-014i-9000000000-9574533b450f3724a645

0 references

splash10-0giu-1290000000-c402be3d2864520be5fb

0 references

splash10-03dl-0098000000-f0d050ef36094b37e62d

0 references

1 reference

Hazardous Substances Data Bank

publication date

28 October 2019

EFAVIRENZ (English)

10 May 2021

DSSTox substance ID

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

DSSTOX compound identifier

0 references

0 references

0 references

620-492-6

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

(4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one (English)

CAS no.: 154598-52-4 (English)

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

(4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one (English)

CAS no.: 154598-52-4 (English)

1 reference

language of work or name

Efavirenz (English)

publication date

17 November 2015

World Health Organisation international non-proprietary name numeric ID

0 references

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

5 February 2021

MeSH descriptor ID

subject named as

efavirenz

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

1 reference

Global Substance Registration System

language of work or name

efavirenz (English)

18 November 2016

1 reference

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

2 references

Global Substance Registration System

language of work or name

efavirenz (English)

18 November 2016

matched by identifier from

XPOQHMRABVBWPR-ZDUSSCGKSA-N

MedlinePlus drug identifier

0 references

NIAID ChemDB ID

1 reference

imported from Wikimedia project

English Wikipedia

1 reference

Global Substance Registration System

language of work or name

efavirenz (English)

18 November 2016

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

efavirenz (English)

19 October 2016

IEDB Epitope ID

1 reference

Immune Epitope Database and Analysis Resource

IEDB Epitope ID

1 March 2022

0 references

1 reference

1 reference

6 April 2020

electronic Essential Medicines List medicine ID

1 reference

https://list.essentialmeds.org/medicines/450

eEML - Electronic Essential Medicines List (English)

23 October 2021

1 reference

Freebase Data Dumps

publication date

28 October 2013

1 reference

9 July 2020

Microsoft Academic ID

0 references

NCI Dictionary of Cancer Terms entry

0 references

1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

PDB structure ID

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1IKV (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1IKW (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1FK9 (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1FKO (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

1JKH (English)

19 October 2016

1 reference

Protein Data Bank

PDB structure ID

language of work or name

4B3O (English)

19 October 2016

1 reference

Global Substance Registration System

language of work or name

efavirenz (English)

18 November 2016

WikiProjectMed ID

0 references

Sitelinks

Wikipedia(27 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(1 entry)

commonswiki Category:Efavirenz

Retrieved from "https://www.wikidata.org/w/index.php?title=Q422645&oldid=2186678161"