HEXOBENDINE

Possibly Marketed Outside US

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H44N2O10
Molecular Weight	592.6778
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC(=CC(OC)=C1OC)C(=O)OCCCN(C)CCN(C)CCCOC(=O)C2=CC(OC)=C(OC)C(OC)=C2

InChI

InChIKey=KRQAMFQCSAJCRH-UHFFFAOYSA-N

InChI=1S/C30H44N2O10/c1-31(11-9-15-41-29(33)21-17-23(35-3)27(39-7)24(18-21)36-4)13-14-32(2)12-10-16-42-30(34)22-19-25(37-5)28(40-8)26(20-22)38-6/h17-20H,9-16H2,1-8H3

HIDE SMILES / InChI

Molecular Formula	C30H44N2O10
Molecular Weight	592.6778
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/20501198 | https://www.ncbi.nlm.nih.gov/pubmed/1168469 | https://www.ncbi.nlm.nih.gov/pubmed/5331101 | https://www.ncbi.nlm.nih.gov/pubmed/4885101 | https://www.ncbi.nlm.nih.gov/pubmed/6056177

Hexobendine (Ustimon or ST7090) is a vasodilator. It inhibits uptake of adenosine and cAMP. Hexobendine was investigated in clinical trials for the treatment of cerebrovascular and coronary artery diseases.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Sodium channel alpha subunits; brain (Types I, II, III) 28 Target ID: CHEMBL2096682 Sources: https://www.ncbi.nlm.nih.gov/pubmed/2579237	Inhibitor 8504		1.4 µM [IC50]
adenosine metabolic process 2 Target ID: GO:0046085 Sources: https://www.ncbi.nlm.nih.gov/pubmed/1168469 \| https://www.ncbi.nlm.nih.gov/pubmed/744550	Modulator 846		0.7 µM [IC50]

PubMed

Title	Date	PubMed
Release of adenosine and ATP during ischemia and epilepsy.	2009-09	20190959
Short-term and long-term cognitive function and cerebral perfusion in off-pump and on-pump coronary artery bypass patients.	2006-01	16337804
[Use of instenon in complex treatment of patients with optic nerve atrophy caused by craniocerebral trauma].	2004-01-08	14708165
[Pharmacological prevention of cerebrovascular complications in cardiac patients after coronary artery bypass surgery].	2003	12830521
[The use of instenon in children with minimal brain dysfunction].	2002	12087730

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:51:26 GMT 2025` Edited by `admin` on `Mon Mar 31 17:51:26 GMT 2025`
Record UNII	B6X4SYR93B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,4,5-TRIMETHOXYBENZOIC ACID, DIESTER WITH 3,3'-(ETHYLENEBIS(METHYLIMINO))DI-1-PROPANOL

Preferred Name

English

HEXOBENDINE

Official Name

English

Hexobendine [WHO-DD]

Common Name

English

HEXOBENDINE [MART.]

Common Name

English

HEXOBENDINE [MI]

Common Name

English

HEXOBENDINE [USAN]

Common Name

English

hexobendine [INN]

Common Name

English

BENZOIC ACID, 3,4,5-TRIMETHOXY-, 1,2-ETHANEDIYLBIS((METHYLIMINO)-3,1-PROPANEDIYL) ESTER

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707