DIBUPROL

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H24O3
Molecular Weight	204.3065
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIBUPROL

Structure Search

SMILES

CCCCOCC(O)COCCCC

InChI

InChIKey=ABSDZQDZDHJMPX-UHFFFAOYSA-N

InChI=1S/C11H24O3/c1-3-5-7-13-9-11(12)10-14-8-6-4-2/h11-12H,3-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C11H24O3
Molecular Weight	204.3065
Charge	0
Count

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

Description
Sources: DOI: 10.1080/10426500490459722 | Elks, J. (2014) The Dictionary of Drugs, page 380, retrieved from: https://books.google.ru/books?id=0vXTBwAAQBAJ

Dibuprol is a muscle relaxant and choleretic drug.

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:47:24 GMT 2023` Edited by `admin` on `Sat Dec 16 16:47:24 GMT 2023`
Record UNII	1627CY4S8U
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DIBUPROL

Official Name

English

1,3-DIBUTOXY-2-PROPANOL

Systematic Name

English

NSC-71470

Code

English

dibuprol [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C66913

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

Code System Code Type Description

ECHA (EC/EINECS)

218-697-7

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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CAS

2216-77-5

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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NSC

71470

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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EPA CompTox

DTXSID40176692

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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PUBCHEM

16669

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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NCI_THESAURUS

C77839

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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ChEMBL

CHEMBL2106237

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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SMS_ID

100000082890

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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FDA UNII

1627CY4S8U

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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INN

3649

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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EVMPD

SUB07078MIG

Created by admin on Sat Dec 16 16:47:24 GMT 2023 , Edited by admin on Sat Dec 16 16:47:24 GMT 2023

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Related Record Type Details


					1627CY4S8U

DIBUPROL

ACTIVE MOIETY