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Details

Stereochemistry ACHIRAL
Molecular Formula C23H27N3O4.ClH
Molecular Weight 445.939
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENEXATE HYDROCHLORIDE

SMILES

Cl.NC(=N)NC[C@H]1CC[C@@H](CC1)C(=O)OC2=C(C=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChIKey=ZNYYFCHDQJQKOK-AELULUIVSA-N
InChI=1S/C23H27N3O4.ClH/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17;/h1-9,16,18H,10-15H2,(H4,24,25,26);1H/t16-,18-;

HIDE SMILES / InChI

Description
Curator's Comment: description was created based on several sources, including, http://www.ncbi.nlm.nih.gov/pubmed/27446246

Benexate is an active ingredient of benexate.CD or benexate hydrochloride betadex, a beta-cyclodextrin complex. Benexate was approved for the treatment of Gastric Ulcer in Japan. The terapeuthic effect of benexate is associated with promotion of prostaglandin synthesis, inhibition of acid secretion and increase in mucosal blood flow.

Approval Year

PubMed

PubMed

TitleDatePubMed
Syntheses and inhibitory effects on gastric lesions of trans-guanidinomethylcyclohexane carboxylic acid arylamides.
1993 Mar
In-vitro and in-vivo antibacterial activity of plaunotol, a cytoprotective antiulcer agent, against Helicobacter pylori.
1996 May
Differential effect of benexate hydrochloride betadex on prostaglandin levels in stomach and inflammatory site in rats.
1996 Oct
Benexate hydrochloride betadex modulates nitric oxide synthesis and cytokine expression in gastric ulcers.
2016 Aug
Patents

Patents

Sample Use Guides

Unknown
Route of Administration: Oral
In Vitro Use Guide
Unknown
Name Type Language
BENEXATE HYDROCHLORIDE
MART.   MI   WHO-DD  
Common Name English
Benexate hcl beta-cyclodextrin clathrate [WHO-DD]
Common Name English
Benexate hydrochloride [WHO-DD]
Common Name English
BENEXATE HCL
Common Name English
BENEXATE HYDROCHLORIDE [MI]
Common Name English
BENZYL SALICYLATE TRANS-4-(GUANIDINOMETHYL)CYCLOHEXANECARBOXYLATE HYDROCHLORIDE
Systematic Name English
BENZOIC ACID, 2-(((TRANS-4-(((AMINOIMINOMETHYL)AMINO)METHYL)CYCLOHEXYL)CARBONYL)OXY)-, PHENYLMETHYL ESTER, HYDROCHLORIDE (1:1)
Common Name English
BENEXATE HYDROCHLORIDE [MART.]
Common Name English
(±)-BENEXATE HYDROCHLORIDE
Common Name English
Code System Code Type Description
MERCK INDEX
m2310
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY Merck Index
SMS_ID
100000085015
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY
FDA UNII
QVN4YYK2C6
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY
EVMPD
SUB00700MIG
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY
CAS
78718-25-9
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID80999968
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY
MERCK INDEX
m2310
Created by admin on Fri Dec 15 17:43:44 GMT 2023 , Edited by admin on Fri Dec 15 17:43:44 GMT 2023
PRIMARY Merck Index