KEGG   COMPOUND: C07018
Entry
C07018                      Compound                               
Name
Gabapentin
Formula
C9H17NO2
Exact mass
171.1259
Mol weight
171.2368
Structure
Remark
Same as: D00332
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02B OTHER ANALGESICS AND ANTIPYRETICS
    N02BF Gabapentinoids
     N02BF01 Gabapentin
      D00332  Gabapentin (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Anticonvulsants
  Gamma-aminobutyric Acid (GABA) Augmenting Agents
   GABA Agents, Other
    Gabapentin
     D00332  Gabapentin (JAN/USP/INN)
 Central Nervous System Agents
  Central Nervous System, Other
   Gabapentin
    D00332  Gabapentin (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   113  Antiepileptics
    1139  Others
     D00332  Gabapentin (JAN/USP/INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01574  Calcium channel alpha-2 delta blocker
   DG01245  Gabapentin
    D00332  Gabapentin
  DG03199  Antiepileptic agent
   DG02037  GABA mimetic antiepileptic
    DG01245  Gabapentin
     D00332  Gabapentin
Drug classes [BR:br08332]
 Neuropsychiatric agent
  DG03199  Antiepileptic agent
   D00332  Gabapentin
Target-based classification of drugs [BR:br08310]
 Ion channels
  Voltage-gated ion channels
   Calcium channels
    CACNA2D
     D00332  Gabapentin (JAN/USP/INN) <JP/US>
 Transporters
  Solute carrier family
   SLC6
    SLC6A1 (GAT1)
     D00332  Gabapentin (JAN/USP/INN) <JP/US>
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00332
Prodrugs [br08324.html]
 D00332
Prodrugs [br08324.html]
 C07018
Other DBs
CAS: 60142-96-3
PubChem: 9230
PDB-CCD: GBN[PDBj]
LinkDB
KCF data

ATOM        12
            1   C6a C    26.5153  -17.2073
            2   O6a O    27.7091  -17.9095
            3   C1b C    25.3215  -17.9095
            4   O6a O    26.5153  -15.8029
            5   C1z C    24.1278  -17.2073
            6   C1b C    22.9340  -17.9095
            7   N1a N    21.7403  -17.2073
            8   C1x C    22.9340  -15.1006
            9   C1x C    22.9340  -16.5051
            10  C1x C    25.3918  -16.5051
            11  C1x C    25.3918  -15.1006
            12  C1x C    24.1278  -14.3984
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     3   5 1
            5     5   6 1
            6     6   7 1
            7     8   9 1
            8     9   5 1
            9    10  11 1
            10   11  12 1
            11    8  12 1
            12    5  10 1

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