KEGG   DRUG: NaltrexoneHelp
Entry
D05113                      Drug                                   

Name
Naltrexone (USAN/INN);
Vivitrol (TN)
Product
Formula
C20H23NO4
Exact mass
341.1627
Mol weight
341.4009
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
Same as: C07253
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]
OPRK1 [HSA:4986] [KO:K04214]
OPRD1 [HSA:4985] [KO:K04213]
  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
      D05113  Naltrexone (USAN/INN) <US>
USP drug classification [BR:br08302]
 Anti-Addiction/Substance Abuse Treatment Agents
  Alcohol Deterrents/Anti-craving
   Naltrexone
    D05113  Naltrexone (USAN/INN)
  Opioid Dependence Treatments
   Naltrexone
    D05113  Naltrexone (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D05113  Naltrexone (USAN/INN) <US>
    OPRK1
     D05113  Naltrexone (USAN/INN) <US>
    OPRD1
     D05113  Naltrexone (USAN/INN) <US>
BRITE hierarchy
Other DBs
CAS: 16590-41-3
PubChem: 47206838
ChEBI: 7465
ChEMBL: CHEMBL19019
DrugBank: DB00704
LigandBox: D05113
NIKKAJI: J9.044A
LinkDB All DBs
KCF data Show

ATOM        25
            1   C1z C    46.6394  -16.7446
            2   C8y C    46.6394  -15.4129
            3   C1z C    47.8309  -17.4454
            4   C1y C    45.5180  -17.3753
            5   C1x C    47.8309  -16.1138
            6   C8y C    45.5180  -14.7821
            7   C8y C    47.8309  -14.7821
            8   C1y C    48.9523  -16.7446
            9   C1x C    47.8309  -18.7070
            10  O2x O    44.2564  -16.0437
            11  C5x C    45.5180  -18.7070
            12  C1x C    50.0737  -16.1138
            13  C8y C    45.5180  -13.4504
            14  C1x C    48.9523  -15.4830
            15  C8x C    47.8309  -13.4504
            16  N1y N    50.0737  -17.4454
            17  C1x C    46.6394  -19.4079
            18  C8x C    46.7095  -12.8196
            19  O1a O    44.4667  -12.8196
            20  O1a O    49.0924  -18.3566
            21  C1b C    51.4754  -17.4454
            22  C1y C    52.1763  -18.6369
            23  C1x C    52.1241  -20.0403
            24  C1x C    53.3435  -19.3117
            25  O5x O    44.2872  -19.3893
BOND        30
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 2
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1 #Down
            10    4  11 1
            11    5  12 1
            12    6  13 1
            13    7  14 1
            14    7  15 2
            15    8  16 1 #Up
            16    9  17 1
            17   13  18 2
            18   13  19 1
            19    6  10 1
            20    8  14 1
            21   11  17 1
            22   12  16 1
            23   15  18 1
            24    3  20 1 #Up
            25   16  21 1
            26   21  22 1
            27   22  23 1
            28   22  24 1
            29   23  24 1
            30   11  25 2

» Japanese version   » Back

DBGET integrated database retrieval system