DEXECADOTRIL

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H23NO4S
Molecular Weight	385.477
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEXECADOTRIL

Structure Search

SMILES

CC(=O)SC[C@H](CC1=CC=CC=C1)C(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChIKey=ODUOJXZPIYUATO-IBGZPJMESA-N

InChI=1S/C21H23NO4S/c1-16(23)27-15-19(12-17-8-4-2-5-9-17)21(25)22-13-20(24)26-14-18-10-6-3-7-11-18/h2-11,19H,12-15H2,1H3,(H,22,25)/t19-/m0/s1

HIDE SMILES / InChI

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/12370063 | https://www.ncbi.nlm.nih.gov/pubmed/28477056 | DOI: 10.3390/molecules21010075

Dexecadotril is powerful and selective inhibitor of neprilysin. It is anti-hypotensive agent. Dexecadotril was found to possess chemoprotective activity. It might be biologically active against multiple myeloma. It was under clinical evaluation as an intestinal antisecretatory agent.

Approval Year

Patents

Patents

Sample Use Guides

In Vivo Use Guide

Dose: 75 mg

Route of Administration: Oral

Name

Type

Language

DEXECADOTRIL

Official Name

English

Retorphan

Common Name

English

dexecadotril [INN]

Common Name

English

(+)-N-((R)-.ALPHA.-(MERCAPTOMETHYL)HYDROCINNAMOYL)GLYCINE, BENZYL ESTER, ACETATE (ESTER)

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C783

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

Code System Code Type Description

NCI_THESAURUS

C77582

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INN

7377

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SMS_ID

100000083201

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ChEMBL

CHEMBL2104660

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PUBCHEM

3086546

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MESH

C469873

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CAS

112573-72-5

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EVMPD

SUB07024MIG

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EPA CompTox

DTXSID90150104

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

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FDA UNII

5OFI9D9892

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

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ACTIVE MOIETY


					GC7MVJ3HGZ

Thiorphan, (R)-

SUBSTANCE RECORD


					5OFI9D9892