ACEQUINOLINE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H15NO2
Molecular Weight	229.2744
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ACEQUINOLINE

Structure Search

SMILES

COC1=CC2=C(C=C1)C(C)=C(C(C)=O)C(C)=N2

InChI

InChIKey=JKZQRPQTPLGSDW-UHFFFAOYSA-N

InChI=1S/C14H15NO2/c1-8-12-6-5-11(17-4)7-13(12)15-9(2)14(8)10(3)16/h5-7H,1-4H3

HIDE SMILES / InChI

Molecular Formula	C14H15NO2
Molecular Weight	229.2744
Charge	0
Count

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

Description
Sources: https://books.google.ru/books?id=0vXTBwAAQBAJ&pg=PA8&lpg=PA8&dq=ACEQUINOLINE retrieved from The Dictionary of Drugs: Chemical Data. Chemical Data, Structures and Bibliographies. Editors: Elks, J., p.8. | https://apps.who.int/medicinedocs/en/d/Js4895e/6.html

Acequinoline (CB 4985) is an analgesic, antiinflammatory agent. It is also antirheumatic, antigout (antimalarial).

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:28:07 GMT 2023` Edited by `admin` on `Fri Dec 15 15:28:07 GMT 2023`
Record UNII	FKJ64U4XOB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ACEQUINOLINE

Official Name

English

CB 4985

Code

English

CB-4985

Code

English

acequinoline [INN]

Common Name

English

7-METHOXY-2,4-DIMETHYL-3-QUINOLYL METHYL KETONE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C241

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

Code System Code Type Description

FDA UNII

FKJ64U4XOB

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

PRIMARY

CAS

42465-20-3

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

PRIMARY

PUBCHEM

170370

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

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EVMPD

SUB05215MIG

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

PRIMARY

INN

2708

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

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NCI_THESAURUS

C74114

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

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EPA CompTox

DTXSID10195239

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

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SMS_ID

100000087917

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

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ChEMBL

CHEMBL2104051

Created by admin on Fri Dec 15 15:28:07 GMT 2023 , Edited by admin on Fri Dec 15 15:28:07 GMT 2023

PRIMARY

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					FKJ64U4XOB

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