KEGG   DRUG: Amobarbital
Entry
D00555                      Drug                                   
Name
Amobarbital (JP18/INN);
Isomytal (TN)
Formula
C11H18N2O3
Exact mass
226.1317
Mol weight
226.27
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01837  Barbiturate sedative-hypnotics
 DG01567  GABA-A receptor agonist
Metabolizing enzyme inducer
 DG02853  CYP3A/CYP3A4 inducer
Remark
Same as: C07536
ATC code: N05CA02
Chemical structure group: DG00916
Efficacy
Sedative-hypnotic
Comment
Barbiturates
Target
GABR [HSA:2554 2555 2556 2557 2558 2559 2560 2561 2562 2563 2564 2565 2566 2567 2568 55879] [KO:K05175 K05181 K05184 K05185 K05186 K05189 K05192]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04727  GABAergic synapse
Interaction
CYP induction: CYP3A [HSA:1576 1577 1551]
Structure map
map07032  Hypnotics
map07230  GABA-A receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05C HYPNOTICS AND SEDATIVES
    N05CA Barbiturates, plain
     N05CA02 Amobarbital
      D00555  Amobarbital (JP18/INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01837  Barbiturate sedative-hypnotics
   DG00916  Amobarbital
    D00555  Amobarbital
  DG01567  GABA-A receptor agonist
   DG00916  Amobarbital
    D00555  Amobarbital
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG00916  Amobarbital
    D00555  Amobarbital
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   GABA (ionotropic)
    GABR
     D00555  Amobarbital (JP18/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00555  Amobarbital
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00555
Narcotics and psychotropics in Japan [br08308.html]
 Psychotropics by Cabinet order Article 3 (78 substances)
  D00555
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01837  Barbiturate sedative-hypnotics
   DG00916  Amobarbital
  DG01567  GABA-A receptor agonist
   DG00916  Amobarbital
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG00916  Amobarbital
Other DBs
CAS: 57-43-2
PubChem: 7847621
ChEBI: 2673
LigandBox: D00555
NIKKAJI: J1.381A
LinkDB
KCF data

ATOM        16
            1   C1z C    20.9187  -17.4474
            2   C5x C    20.9187  -18.8579
            3   C5x C    19.7006  -16.7423
            4   C1b C    22.4050  -17.4533
            5   C1b C    20.9071  -16.0952
            6   N1x N    19.7006  -19.5633
            7   O5x O    22.1311  -19.5633
            8   N2x N    18.4767  -17.4474
            9   O5x O    19.7006  -15.3377
            10  C1b C    23.1103  -16.4509
            11  C1a C    22.1195  -15.3841
            12  C2y C    18.4767  -18.8579
            13  C1c C    24.5440  -16.4566
            14  O1a O    17.2525  -19.5633
            15  C1a C    25.2493  -17.6748
            16  C1a C    25.2493  -15.2385
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 2
            7     3   8 1
            8     3   9 2
            9     4  10 1
            10    5  11 1
            11    6  12 1
            12   10  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 1
            16    8  12 2

» Japanese version   » Back

KEGG   DRUG: Amobarbital sodium
Entry
D02252                      Drug                                   
Name
Amobarbital sodium (JAN/USP);
Amytal sodium (TN)
Formula
C11H17N2O3. Na
Exact mass
248.1137
Mol weight
248.25
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01837  Barbiturate sedative-hypnotics
 DG01567  GABA-A receptor agonist
Metabolizing enzyme inducer
 DG02853  CYP3A/CYP3A4 inducer
Remark
ATC code: N05CA02
Chemical structure group: DG00916
Efficacy
Sedative-hypnotic
Comment
Barbiturates
Target
GABR [HSA:2554 2555 2556 2557 2558 2559 2560 2561 2562 2563 2564 2565 2566 2567 2568 55879] [KO:K05175 K05181 K05184 K05185 K05186 K05189 K05192]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04727  GABAergic synapse
Interaction
CYP induction: CYP3A [HSA:1576 1577 1551]
Structure map
map07032  Hypnotics
map07230  GABA-A receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05C HYPNOTICS AND SEDATIVES
    N05CA Barbiturates, plain
     N05CA02 Amobarbital
      D02252  Amobarbital sodium (JAN/USP)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01837  Barbiturate sedative-hypnotics
   DG00916  Amobarbital
    D02252  Amobarbital sodium
  DG01567  GABA-A receptor agonist
   DG00916  Amobarbital
    D02252  Amobarbital sodium
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG00916  Amobarbital
    D02252  Amobarbital sodium
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   GABA (ionotropic)
    GABR
     D02252  Amobarbital sodium (JAN/USP)
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D02252
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01837  Barbiturate sedative-hypnotics
   DG00916  Amobarbital
  DG01567  GABA-A receptor agonist
   DG00916  Amobarbital
 Metabolizing enzyme inducer
  DG02853  CYP3A/CYP3A4 inducer
   DG00916  Amobarbital
Other DBs
CAS: 64-43-7
PubChem: 7849311
LigandBox: D02252
NIKKAJI: J95.719D
LinkDB
KCF data

ATOM        17
            1   C1z C    21.8287  -17.3774
            2   C5x C    21.8287  -18.7879
            3   C5x C    20.6106  -16.6723
            4   C1b C    23.3150  -17.3833
            5   C1b C    21.8171  -16.0252
            6   N1x N    20.6106  -19.4933
            7   O5x O    23.0411  -19.4933
            8   N2x N    19.3867  -17.3774
            9   O5x O    20.6106  -15.2677
            10  C1b C    24.0203  -16.3809
            11  C1a C    23.0295  -15.3141
            12  C2y C    19.3867  -18.7879
            13  C1c C    25.4540  -16.3866
            14  O1a O    18.1625  -19.4933 #-
            15  C1a C    26.1593  -17.6048
            16  C1a C    26.1593  -15.1685
            17  Z   Na   16.0533  -19.5067 #+
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 2
            7     3   8 1
            8     3   9 2
            9     4  10 1
            10    5  11 1
            11    6  12 1
            12   10  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 1
            16    8  12 2

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