IBUVERINE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H26O3
Molecular Weight	290.3972
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of IBUVERINE

Structure Search

SMILES

CC(C)COC(=O)C(O)(C1CCCCC1)C2=CC=CC=C2

InChI

InChIKey=ARZBHIWSBXERKM-UHFFFAOYSA-N

InChI=1S/C18H26O3/c1-14(2)13-21-17(19)18(20,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3,5-6,9-10,14,16,20H,4,7-8,11-13H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C18H26O3
Molecular Weight	290.3972
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Description
Sources: Elks J., The Dictionary of Drugs: Chemical Data: Chemical Data, Structures retrieved from: https://books.google.ru/books?id=0vXTBwAAQBAJ&pg=RA1-PA569&lpg=RA1-PA569&dq=Ibuverine+Antispasmodic&source=bl&ots=6JTnn4Yytz&sig=ACfU3U0PTihiyCvYxME7yvGeqGuHQeqDxg&hl=ru&sa=X&ved=2ahUKEwi4qeGso77iAhWC6aYKHVeNCDkQ6AEwB3oECAgQAQ#v=onepage&q=Ibuverine%20Antispasmodic&f=false

Ibuverine was studied as an antispasmodic agent. Information about the current use of this drug is not available.

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:08:48 GMT 2023` Edited by `admin` on `Fri Dec 15 17:08:48 GMT 2023`
Record UNII	73571P162L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

IBUVERINE

Official Name

English

ibuverine [INN]

Common Name

English

ISOBUTYL .ALPHA.-PHENYLCYCLOHEXANEGLYCOLATE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C66880

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

Code System Code Type Description

PUBCHEM

163313

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

PRIMARY

SMS_ID

100000083670

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

PRIMARY

ChEMBL

CHEMBL2104313

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

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EVMPD

SUB08103MIG

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

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INN

2657

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

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FDA UNII

73571P162L

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

PRIMARY

NCI_THESAURUS

C83776

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

PRIMARY

EPA CompTox

DTXSID00865590

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

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CAS

31221-85-9

Created by admin on Fri Dec 15 17:08:48 GMT 2023 , Edited by admin on Fri Dec 15 17:08:48 GMT 2023

PRIMARY

Related Record Type Details


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IBUVERINE, (S)-

ENANTIOMER -> RACEMATE

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					73571P162L

IBUVERINE

ACTIVE MOIETY