KEGG   DRUG: AprobarbitalHelp
Entry
D00698                      Drug                                   

Name
Aprobarbital (INN);
Alurate (TN)
Formula
C10H14N2O3
Exact mass
210.1004
Mol weight
210.2298
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01837  Barbiturate sedative-hypnotics
Remark
Same as: C07826
ATC code: N05CA05
Efficacy
Sedative-hypnotic
Comment
Barubiturat
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04727  GABAergic synapse
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05C HYPNOTICS AND SEDATIVES
    N05CA Barbiturates, plain
     N05CA05 Aprobarbital
      D00698  Aprobarbital (INN)
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   GABA (ionotropic)
    GABR
     D00698  Aprobarbital (INN)
BRITE hierarchy
Other DBs
CAS: 77-02-1
PubChem: 7847763
ChEBI: 2791
ChEMBL: CHEMBL7863
DrugBank: DB01352
LigandBox: D00698
NIKKAJI: J38.379A
LinkDB All DBs
KCF data Show

ATOM        15
            1   C1z C    21.9683  -18.0308
            2   C5x C    21.9683  -19.4312
            3   C5x C    20.7547  -17.3306
            4   C1b C    21.9626  -16.6363
            5   C1c C    23.3570  -18.0308
            6   N1x N    20.7547  -20.1373
            7   O5x O    23.1821  -20.1373
            8   N1x N    19.5352  -18.0308
            9   O5x O    20.7547  -15.9304
            10  C2b C    23.1761  -15.9361
            11  C1a C    24.0455  -16.8230
            12  C1a C    24.0572  -19.2445
            13  C5x C    19.5352  -19.4312
            14  C2a C    23.1761  -14.5417
            15  O5x O    18.3217  -20.1373
BOND        15
            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    5  12 1
            12    6  13 1
            13   10  14 2
            14   13  15 2
            15    8  13 1

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