METABUTETHAMINE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H20N2O2
Molecular Weight	236.3101
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METABUTETHAMINE

Structure Search

SMILES

CC(C)CNCCOC(=O)C1=CC(N)=CC=C1

InChI

InChIKey=BXMFKNRZTLNAFY-UHFFFAOYSA-N

InChI=1S/C13H20N2O2/c1-10(2)9-15-6-7-17-13(16)11-4-3-5-12(14)8-11/h3-5,8,10,15H,6-7,9,14H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C13H20N2O2
Molecular Weight	236.3101
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/4324238

Metabutethamine hydrochloride was used as a local anesthetic.

Approval Year

Sourcing

Sourcing

Vendor/Aggregator	ID	URL
ABI Chem	AC1L1WNE
Chemieliva Pharmaceutical Co., Ltd	PBCM1308741
Compound Cloud	11115
ZINC	ZINC000001672766	http://zinc15.docking.org/substances/ZINC000001672766
eMolecules	260196827

PubMed

PubMed

Title	Date	PubMed
[Syringo-epithelioma of the skin].	1970	4324238

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 14:58:11 GMT 2023` Edited by `admin` on `Fri Dec 15 14:58:11 GMT 2023`
Record UNII	PSJ9VIF3RV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METABUTETHAMINE

Common Name

English

2-(ISOBUTYLAMINO)ETHANOL M-AMINOBENZOATE

Systematic Name

English

Metabutethamine [WHO-DD]

Common Name

English

Classification Tree Code System Code

WHO-ATC

N01BA01

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

NCI_THESAURUS

C245

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

WHO-VATC

QN01BA01

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

Code System Code Type Description

DRUG CENTRAL

4658

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

NCI_THESAURUS

C81413

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

EPA CompTox

DTXSID60196150

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

DRUG BANK

DB13578

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

WIKIPEDIA

METABUTETHAMINE

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

FDA UNII

PSJ9VIF3RV

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

PUBCHEM

11115

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

CAS

4439-25-2

Created by admin on Fri Dec 15 14:58:11 GMT 2023 , Edited by admin on Fri Dec 15 14:58:11 GMT 2023

PRIMARY

Related Record Type Details


					36IME48STO

METABUTETHAMINE HYDROCHLORIDE

SALT/SOLVATE -> PARENT

Related Record Type Details


					PSJ9VIF3RV

METABUTETHAMINE

ACTIVE MOIETY