BUTINOLINE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H21NO
Molecular Weight	291.3868
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTINOLINE

Structure Search

SMILES

OC(C#CCN1CCCC1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=LWPXJPFOEPMIRG-UHFFFAOYSA-N

InChI=1S/C20H21NO/c22-20(18-10-3-1-4-11-18,19-12-5-2-6-13-19)14-9-17-21-15-7-8-16-21/h1-6,10-13,22H,7-8,15-17H2

HIDE SMILES / InChI

Molecular Formula	C20H21NO
Molecular Weight	291.3868
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/14332781

Butinoline (also known as azulone) was used as an antispasmodic drug to treat gastritis.

Approval Year

Conditions

Conditions

Condition	Modality	Targets	Highest Phase	Product
Gastritis 45 Sources: https://www.ncbi.nlm.nih.gov/pubmed/14916619	Primary		Not Provided 504	Unknown Approved Use Unknown

PubMed

PubMed

Title	Date	PubMed
[Treatment of gastritis; clinical observations of the effect of azulone].	1952 Jan 4	14916619

Patents

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:06:09 GMT 2023` Edited by `admin` on `Fri Dec 15 16:06:09 GMT 2023`
Record UNII	G216926E9T
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BUTINOLINE

Official Name

English

butinoline [INN]

Common Name

English

Butinoline [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29704

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

Code System Code Type Description

EPA CompTox

DTXSID3046295

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

PRIMARY

FDA UNII

G216926E9T

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

PRIMARY

ChEMBL

CHEMBL1442660

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

PRIMARY

CAS

968-63-8

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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DRUG CENTRAL

448

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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WIKIPEDIA

BUTINOLINE

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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SMS_ID

100000088612

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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INN

1631

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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NCI_THESAURUS

C78064

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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EVMPD

SUB06020MIG

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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PUBCHEM

68943

Created by admin on Fri Dec 15 16:06:09 GMT 2023 , Edited by admin on Fri Dec 15 16:06:09 GMT 2023

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Related Record Type Details


					EB2657YYBG

BUTINOLINE PHOSPHATE

SALT/SOLVATE -> PARENT

Related Record Type Details


					G216926E9T

ACTIVE MOIETY