naltrexone hydrochloride (CHEBI:134687)

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CHEBI:134687 - naltrexone hydrochloride

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ChEBI ID	CHEBI:134687
ChEBI Name	naltrexone hydrochloride
Stars
Definition	A hydrochloride obtained by reaction of oxycodone with one molar equivalent of hydrochloric acid. it is a μ-opioid receptor antagonist that is used to treat alcohol dependence.
Last Modified	22 February 2017
Submitter	Steve
Downloads	Molfile

Formula	C20H23NO4.HCl
Net Charge	0
Average Mass	377.868
Monoisotopic Mass	377.13939
SMILES	Cl.O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5
InChI	InChI=1S/C20H23NO4.ClH/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11;/h3-4,11,15,18,22,24H,1-2,5-10H2;1H/t15-,18+,19+,20-;/m1./s1
InChIKey	RHBRMCOKKKZVRY-ITLPAZOVSA-N

Wikipedia

Roles Classification

Biological Role:	mu-opioid receptor antagonist Any compound that exhibits antagonist activity at the μ-opioid receptor
Applications:	antidote to opioid poisoning A role borne by a molecule that acts to counteract or neutralise the deleterious effects of opioids. central nervous system depressant A loosely defined group of drugs that tend to reduce the activity of the central nervous system. mu-opioid receptor antagonist Any compound that exhibits antagonist activity at the μ-opioid receptor

ChEBI Ontology

Outgoing Relation(s)
	naltrexone hydrochloride (CHEBI:134687) has part naltrexone(1+) (CHEBI:134688)
	naltrexone hydrochloride (CHEBI:134687) has role antidote to opioid poisoning (CHEBI:90755)
	naltrexone hydrochloride (CHEBI:134687) has role central nervous system depressant (CHEBI:35488)
	naltrexone hydrochloride (CHEBI:134687) has role μ-opioid receptor antagonist (CHEBI:50137)
	naltrexone hydrochloride (CHEBI:134687) is a hydrochloride (CHEBI:36807)
Incoming Relation(s)
Incoming Relation(s)	Troxyca ER (CHEBI:134679) has part naltrexone hydrochloride (CHEBI:134687)

IUPAC Names
17-(cyclopropylmethyl)-3,14-dihydroxy-4,5α-epoxymorphinan-6-one hydrochloride
(5α,17R)-17-(cyclopropylmethyl)-3,14-dihydroxy-6-oxo-4,5-epoxymorphinan-17-ium chloride

Synonyms	Source
17-(Cyclopropylmethyl)-4,5-alpha-epoxy-3,14-dihydroxy-morphinan-6-one hydrochloride	ChemIDplus
naltrexone.HCl	ChEBI
naltrexone monohydrochloride	ChEBI
N-Cyclopropylmethyl-noroxymorphone hydrochloride	ChemIDplus

Manual Xrefs	Databases
D02095	KEGG DRUG
DB00704	DrugBank
Naltrexone	Wikipedia

Registry Numbers	Sources
Reaxys:3580333	Reaxys
CAS:16676-29-2	ChemIDplus

Citations