METABUTETHAMINE HYDROCHLORIDE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H20N2O2.ClH
Molecular Weight	272.771
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METABUTETHAMINE HYDROCHLORIDE

Structure Search

SMILES

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

InChI

InChIKey=HKUYLJOKQXCBDY-UHFFFAOYSA-N

InChI=1S/C13H20N2O2.ClH/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;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

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 15:10:18 GMT 2023` Edited by `admin` on `Fri Dec 15 15:10:18 GMT 2023`
Record UNII	36IME48STO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METABUTETHAMINE HYDROCHLORIDE

Common Name

English

2-(ISOBUTYLAMINO)ETHANOL M-AMINOBENZOATE, HYDROCHLORIDE

Systematic Name

English

NSC-41532

Code

English

METABUTETHAMINE HCL

Common Name

English

BUTETHAMINE META-ISOMER HYDROCHLORIDE

Common Name

English

BUTETHAMINE META-ISOMER HYDROCHLORIDE [MI]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C245

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

Code System Code Type Description

CAS

553-58-2

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

NCI_THESAURUS

C81397

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

PUBCHEM

11114

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

FDA UNII

36IME48STO

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

NSC

41532

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

EPA CompTox

DTXSID30203825

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

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MERCK INDEX

m2796

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

Merck Index

ChEMBL

CHEMBL2110959

Created by admin on Fri Dec 15 15:10:18 GMT 2023 , Edited by admin on Fri Dec 15 15:10:18 GMT 2023

PRIMARY

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METABUTETHAMINE

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