KEGG   DRUG: Acamprosate
Entry
D07058                      Drug                                   
Name
Acamprosate (INN);
Aotal (TN)
Formula
C5H11NO4S
Exact mass
181.0409
Mol weight
181.2101
Structure
Class
Neuropsychiatric agent
 DG01498  NMDA receptor antagonist
Remark
ATC code: N07BB03
Chemical structure group: DG00996
Product (DG00996): D02780<JP/US>
Efficacy
Antialcohol dependence, NMDA receptor antagonist
Comment
Alcohol withdrawal agent
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04724  Glutamatergic synapse
hsa04728  Dopaminergic synapse
hsa05034  Alcoholism
Interaction
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
     N07BB03 Acamprosate
      D07058  Acamprosate (INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01498  NMDA receptor antagonist
   DG00996  Acamprosate
    D07058  Acamprosate
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   Glutamate (ionotropic), NMDA
    GRIN (NMDAR)
     D07058  Acamprosate (INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01498  NMDA receptor antagonist
   DG00996  Acamprosate
Other DBs
CAS: 77337-76-9
PubChem: 51091400
ChEBI: 51041
LigandBox: D07058
NIKKAJI: J309.380H
LinkDB
KCF data

ATOM        11
            1   C1a C    26.3833  -17.1326
            2   C5a C    27.5817  -17.8244
            3   N1b N    28.7800  -17.1326
            4   C1b C    29.9783  -17.8244
            5   C1b C    31.1766  -17.1326
            6   C1b C    32.3750  -17.8244
            7   S4a S    33.5734  -17.1326
            8   O5a O    27.5817  -19.2082
            9   O1d O    34.7858  -17.8327
            10  O1d O    34.7858  -16.4326
            11  O1d O    32.3609  -16.4326
BOND        10
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     2   8 2
            8     7   9 1
            9     7  10 2
            10    7  11 2

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