SAMIXOGREL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H25ClN2O4S
Molecular Weight	484.995
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of SAMIXOGREL

Structure Search

SMILES

OC(=O)CCC\C=C(/C1=CC=C(CCNS(=O)(=O)C2=CC=C(Cl)C=C2)C=C1)C3=CC=CN=C3

InChI

InChIKey=LGHLGTHRJNIRCA-ZXKDJJQISA-N

InChI=1S/C25H25ClN2O4S/c26-22-11-13-23(14-12-22)33(31,32)28-17-15-19-7-9-20(10-8-19)24(5-1-2-6-25(29)30)21-4-3-16-27-18-21/h3-5,7-14,16,18,28H,1-2,6,15,17H2,(H,29,30)/b24-5+

HIDE SMILES / InChI

Description
Sources: https://adisinsight.springer.com/drugs/800003383

Boehringer Ingelheim developed samixogrel as thromboxane A2 receptor antagonists. This drug participated in clinical trials for the treatment patients with diabetic complications, thrombosis, and unstable angina pectoris. However, all these studies were discontinued.

Originator

Approval Year

PubMed

PubMed

Title	Date	PubMed
Guanidine derivatives as combined thromboxane A2 receptor antagonists and synthase inhibitors.	1999-04-08	10197967

Name

Type

Language

SAMIXOGREL

Official Name

English

samixogrel [INN]

Preferred Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1327

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

NCI_THESAURUS

C471

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

Code System Code Type Description

EPA CompTox

DTXSID701009931

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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EVMPD

SUB10437MIG

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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PUBCHEM

6436053

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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FDA UNII

5MB73H1ADH

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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NCI_THESAURUS

C73214

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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CAS

133276-80-9

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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SMS_ID

100000084050

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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INN

7222

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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ChEMBL

CHEMBL277689

Created by admin on Mon Mar 31 18:23:21 GMT 2025 , Edited by admin on Mon Mar 31 18:23:21 GMT 2025

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ACTIVE MOIETY


					5MB73H1ADH