KEGG   DRUG: Naltrexone hydrochlorideHelp
Entry
D02095                      Drug                                   

Name
Naltrexone hydrochloride (USP);
ReVia (TN)
Product
  Generic
Formula
C20H23NO4. HCl
Exact mass
377.1394
Mol weight
377.8619
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Analgesic
 DG01586  Opioid receptor antagonist
Other
 DG01718  Drugs for addictive disorder
  DG01716  Drugs for alcohol dependence
Remark
ATC code: N07BB04
Chemical structure group: DG00997
Product (DG00997): D05113<US> D02095<US>
Product (mixture): D10751<US>
Efficacy
Antialcohol dependence, Narcotic antagonist, Opioid receptor antagonist
  Disease
Alcohol dependence [DS:H01611]
Target
OPRM1 [HSA:4988] [KO:K04215]
OPRD1 [HSA:4985] [KO:K04213]
OPRK1 [HSA:4986] [KO:K04214]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa05032  Morphine addiction
Interaction
Drug interaction
Structure map
map07039  Opioid analgesics
map07224  Opioid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N07 OTHER NERVOUS SYSTEM DRUGS
   N07B DRUGS USED IN ADDICTIVE DISORDERS
    N07BB Drugs used in alcohol dependence
     N07BB04 Naltrexone
      D02095  Naltrexone hydrochloride (USP) <US>
USP drug classification [BR:br08302]
 Anti-Addiction/Substance Abuse Treatment Agents
  Alcohol Deterrents/Anti-craving
   Naltrexone
    D02095  Naltrexone hydrochloride (USP)
  Opioid Dependence
   Naltrexone
    D02095  Naltrexone hydrochloride (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D02095  Naltrexone hydrochloride (USP) <US>
    OPRK1
     D02095  Naltrexone hydrochloride (USP) <US>
    OPRD1
     D02095  Naltrexone hydrochloride (USP) <US>
BRITE hierarchy
Other DBs
CAS: 16676-29-2
PubChem: 7849156
ChEBI: 134687
ChEMBL: CHEMBL1201149
DrugBank: DB00704
LigandBox: D02095
NIKKAJI: J321.134G
LinkDB All DBs
KCF data Show

ATOM        26
            1   X   Cl   37.1700  -16.1000
            2   C1z C    29.4000  -17.5000
            3   C8y C    29.4000  -16.1700
            4   C1z C    30.5900  -18.2000
            5   C1y C    28.2800  -18.1300
            6   C1x C    30.5900  -16.8700
            7   C8y C    28.2800  -15.5400
            8   C8y C    30.5900  -15.5400
            9   C1y C    31.7100  -17.5000
            10  C1x C    30.5900  -19.4600
            11  O2x O    27.0200  -16.8000
            12  C5x C    28.2800  -19.4600
            13  C1x C    32.8300  -16.8700
            14  C8y C    28.2800  -14.2100
            15  C1x C    31.7100  -16.2400
            16  C8x C    30.5900  -14.2100
            17  N1y N    32.8300  -18.2000
            18  C1x C    29.4000  -20.1600
            19  C8x C    29.4700  -13.5800
            20  O1a O    27.2300  -13.5800
            21  O1a O    31.8500  -19.1100
            22  C1b C    34.2300  -18.2000
            23  C1y C    34.9300  -19.3900
            24  C1x C    34.9300  -20.7900
            25  C1x C    36.1200  -20.0900
            26  O5x O    27.0900  -20.1600
BOND        30
            1     2   3 1
            2     2   4 1
            3     2   5 1
            4     2   6 1 #Up
            5     3   7 2
            6     3   8 1
            7     4   9 1
            8     4  10 1
            9     5  11 1 #Down
            10    5  12 1
            11    6  13 1
            12    7  14 1
            13    8  15 1
            14    8  16 2
            15    9  17 1 #Up
            16   10  18 1
            17   14  19 2
            18   14  20 1
            19    7  11 1
            20    9  15 1
            21   12  18 1
            22   13  17 1
            23   16  19 1
            24    4  21 1 #Up
            25   17  22 1
            26   22  23 1
            27   23  24 1
            28   23  25 1
            29   24  25 1
            30   12  26 2

» Japanese version   » Back

DBGET integrated database retrieval system