DETOMIDINE HYDROCHLORIDE MONOHYDRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H14N2.ClH.H2O
Molecular Weight	240.729
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DETOMIDINE HYDROCHLORIDE MONOHYDRATE

Structure Search

SMILES

O.Cl.CC1=CC=CC(CC2=CNC=N2)=C1C

InChI

InChIKey=IQBSKEIWIRTMOT-UHFFFAOYSA-N

InChI=1S/C12H14N2.ClH.H2O/c1-9-4-3-5-11(10(9)2)6-12-7-13-8-14-12;;/h3-5,7-8H,6H2,1-2H3,(H,13,14);1H;1H2

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

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	C12H14N2
Molecular Weight	186.253
Charge	0
Count

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

Description
Sources: http://equimed.com/drugs-and-medications/reference/detomidine-hydrochloride |

Detomodine hydrochloride is a sedative with analgesic properties and α2-adrenergic agonist The dose-dependent sedative and analgesic effects reduce production of excitatory neurotransmitters, thereby calming the horse, relieving abdominal pain, and facilitating bronchoscopy and other procedures. Currently, detomidine is only licensed for use in horses.

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Alpha-2 adrenergic receptor 3 Target ID: CHEMBL2111338 Sources: https://www.ncbi.nlm.nih.gov/pubmed/2984021	Agonist 2678

Conditions

Condition	Modality	Targets	Highest Phase	Product
Pain 614 Sources: http://equimed.com/drugs-and-medications/reference/detomidine-hydrochloride	Primary		Approved 8429	Dormosedan Approved Use Unknown

PubMed

Title	Date	PubMed
Standing sedation in African elephants (Loxodonta africana) using detomidine-butorphanol combinations.	2005 Jun	17323566
Effect of defocused CO2 laser on equine tissue perfusion.	2006	16722304
Dissociative anaesthesia during field and hospital conditions for castration of colts.	2006	16722301
Gait pattern of the ataxic horse compared to sedated and nonsedated horses.	2006 Aug	17402459
Comparison of intraoperative pain responses following intratesticular or mesorchial injection of lidocaine in standing horses undergoing laparoscopic cryptorchidectomy.	2006 Dec 1	17144826
Effect of head position on intraocular pressure in horses.	2006 Jul	16817748
Effects of xylazine, medetomidine, detomidine, and diazepam on sedation, heart and respiratory rates, and cloacal temperature in rock partridges (Alectoris graeca).	2006 Jun	17312791
The stress caused by laparoscopy in sheep and its alleviation.	2006 Jun	16751840
Antagonism of detomidine sedation in the horse using intravenous tolazoline or atipamezole.	2006 May	16706278
The effect of hyoscine on dobutamine requirement in spontaneously breathing horses anaesthetized with halothane.	2006 May	16634940
Clinical evaluation of intranasal benzodiazepines, alpha-agonists and their antagonists in canaries.	2006 May	16634939
The influence of alpha-adrenergic receptors stimulator and blockers and beta-blocker on the ovary and endocrinological activity in heifers during superovulation.	2006 Nov	17242481
Adrenergic stimulation and blocking of hormonal secretion activity of cultured cow granulosa cells.	2006 Nov	17242478
Serial chemical restraint for treatment of decubitus ulcers in two neonatal white rhinoceroses (Ceratotherium simum).	2006 Sep	17319140
Left- and right-sided laparoscopic-assisted nephrectomy in standing horses with unilateral renal disease.	2007 Aug	17686131
The use of alpha-2 agonists in the equine practice: comparison between three molecules.	2007 Aug	17682902
Atipamezole in the management of detomidine overdose in a pony.	2007 Jan	17238965
The effects of detomidine, romifidine or acepromazine on echocardiographic measurements and cardiac function in normal horses.	2007 Jan	17238956
Detecting early kidney damage in horses with colic by measuring matrix metalloproteinase -9 and -2, other enzymes, urinary glucose and total proteins.	2007 Jan 23	17244354
Radiographic closure time of appendicular growth plates in the Icelandic horse.	2007 Jul 17	17640333
Caries in the infundibulum of the second upper premolar tooth in the horse.	2007 Mar 28	17391523
Sedation with detomidine and acepromazine influences the endoscopic evaluation of laryngeal function in horses.	2007 Nov	18065315
A point mutation in a herpesvirus polymerase determines neuropathogenicity.	2007 Nov	17997600
Metabolism before, during and after anaesthesia in colic and healthy horses.	2007 Nov 15	18001483
The cardiopulmonary effects of etorphine, azaperone, detomidine, and butorphanol in field-anesthetized white rhinoceroses (Ceratotherium simum).	2007 Sep	17939346
Reversible immobilization of asiatic black bear (Ursus thibetanus) with detomidine-tiletamine-zolazepam and atipamezole.	2008 Dec	19110696
Use of multichannel electrointestinography for noninvasive assessment of myoelectrical activity in the cecum and large colon of horses.	2008 Jun	18518649
Radiographic parameters for diagnosing sand colic in horses.	2008 Jun 13	18554381
Development of a composite orthopaedic pain scale in horses.	2008 Oct	18061637
Pharmacokinetics of detomidine and its metabolites following intravenous and intramuscular administration in horses.	2009 Apr	19562897
Effects of dobutamine on cardiac index and arterial blood pressure in isoflurane-anaesthetized horses under clinical conditions.	2009 Aug	19614840
A comparison of epidural buprenorphine plus detomidine with morphine plus detomidine in horses undergoing bilateral stifle arthroscopy.	2009 Jan	19121161
Vascular perfusion of reproductive organs in pony mares and heifers during sedation with detomidine or xylazine.	2009 Jan	19119960
Analgesic effect of butorphanol in ponies following castration.	2009 Jul	19803050
Comparison of the effects of the alpha-2 agonists detomidine, romifidine and xylazine on nociceptive withdrawal reflex and temporal summation in horses.	2009 Jul	19538573
Steroid hormone receptors ERalpha and PR characterised by immunohistochemistry in the mare adrenal gland.	2009 Jul 22	19624811
Effect of detomidine on visceral and somatic nociception and duodenal motility in conscious adult horses.	2009 Mar	19239655
Comparison of azaperone-detomidine-butorphanol-ketamine and azaperone-tiletamine-zolazepam for anaesthesia in piglets.	2009 Mar	19239653
Metabolism during anaesthesia and recovery in colic and healthy horses: a microdialysis study.	2009 Mar 10	19284560
Pharmacokinetics of detomidine administered to horses at rest and after maximal exercise.	2009 May	19642399
Effect of sedation with detomidine and butorphanol on pulmonary gas exchange in the horse.	2009 May 7	19422714
Plasma concentrations, behavioural and physiological effects following intravenous and intramuscular detomidine in horses.	2009 Nov	20095225
Histological and immunohistochemical evaluation of autologous cultured bone marrow mesenchymal stem cells and bone marrow mononucleated cells in collagenase-induced tendinitis of equine superficial digital flexor tendon.	2010	20445779
Comparison of intraoperative behavioral and hormonal responses to noxious stimuli between mares sedated with caudal epidural detomidine hydrochloride or a continuous intravenous infusion of detomidine hydrochloride for standing laparoscopic ovariectomy.	2010 Aug	20459483
Human exposures to immobilising agents: results of an online survey.	2010 Aug 28	20802186
Tachypnea and antipyresis in febrile horses after sedation with alpha-agonists.	2010 Jul-Aug	20492482
Immobilization and intravenous anesthesia in a Sumatran rhinoceros (Dicerorhinus sumatrensis).	2010 Mar	20722263
Anesthetic management of a white rhinoceros (Ceratotherium simum) undergoing an emergency exploratory celiotomy for colic.	2010 May	20456115
Total intravenous anesthesia with midazolam, ketamine, and xylazine or detomidine following induction with tiletamine, zolazepam, and xylazine in red deer (Cervus elaphus hippelaphus) undergoing surgery.	2010 Oct	20966270
Accidental poisoning with detomidine and butorphanol.	2010 Sep	20573843

Patents

Sample Use Guides

In Vivo Use Guide

for horses: Oral (gel): 0.04 mg/kg; Intravenous or Intramuscular injection: 0.02-0.04 mg/kg

Route of Administration: Other

In Vitro Use Guide

The sedative alpha2-adrenoceptor agonists medetomidine and detomidine inhibited aldosterone release (range 10-1000 nM). The 4-substituted imidazoles atipamezole, detomidine, and medetomidine inhibited mitochondrial cytochrome P450(11beta/18) in vitro.

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:11:18 GMT 2023` Edited by `admin` on `Sat Dec 16 18:11:18 GMT 2023`
Record UNII	44V8Q4D5J6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DETOMIDINE HYDROCHLORIDE MONOHYDRATE

Common Name

English

1H-IMIDAZOLE, 5-((2,3-DIMETHYLPHENYL)METHYL)-, HYDROCHLORIDE, HYDRATE (1:1:1)

Systematic Name

English

5-((2,3-DIMETHYLPHENYL)METHYL)-1H-IMIDAZOLE;HYDRATE;HYDROCHLORIDE

Systematic Name

English

1H-IMIDAZOLE, 4-((2,3-DIMETHYLPHENYL)METHYL)-, MONOHYDROCHLORIDE, MONOHYDRATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40238002