KEGG   COMPOUND: C06817
Entry
C06817                      Compound                               
Name
Alprazolam
Formula
C17H13ClN4
Exact mass
308.0829
Mol weight
308.7649
Structure
Remark
Same as: D00225
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05B ANXIOLYTICS
    N05BA Benzodiazepine derivatives
     N05BA12 Alprazolam
      D00225  Alprazolam (JP18/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Anxiolytics
  Benzodiazepines
   Alprazolam
    D00225  Alprazolam (JP18/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   112  Hypnotics and sedatives, anxiolytics
    1124  Benzodiazepins
     D00225  Alprazolam (JP18/USP/INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01567  GABA-A receptor agonist
   D00225  Alprazolam
  DG01914  Anxiolytics, benzodiazepine derivatives
   D00225  Alprazolam
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   D00225  Alprazolam
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   GABA (ionotropic)
    GABR
     D00225  Alprazolam (JP18/USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00225  Alprazolam
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00225
Narcotics and psychotropics in Japan [br08308.html]
 Psychotropics by Cabinet order Article 3 (78 substances)
  D00225
Other DBs
CAS: 28981-97-7
PubChem: 9035
ChEBI: 2611
PDB-CCD: 08H[PDBj]
NIKKAJI: J9.279G
KCF data

ATOM        22
            1   C2y C    27.8918  -16.7954
            2   C8y C    27.0400  -15.7011
            3   C8y C    27.3569  -14.3464
            4   N4y N    28.6052  -13.7555
            5   N2x N    29.2915  -16.8031
            6   C8y C    29.8607  -14.3595
            7   C1x C    30.1627  -15.7185
            8   C8x C    26.3425  -13.3948
            9   C8x C    25.0114  -13.7976
            10  C8y C    24.6944  -15.1523
            11  C8x C    25.7088  -16.1037
            12  C8y C    27.2653  -18.0670
            13  C8x C    25.8478  -18.0902
            14  C8x C    25.2326  -19.4073
            15  C8x C    26.0054  -20.5636
            16  C8x C    27.4249  -20.6102
            17  C8x C    28.0380  -19.2235
            18  N5x N    30.8232  -13.3521
            19  N5x N    30.1625  -12.1254
            20  C8y C    28.7916  -12.3747
            21  C1a C    27.7850  -11.4129
            22  X   Cl   23.3525  -15.5583
BOND        25
            1     3   4 1
            2     1   5 2
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    1  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 2
            19   12  17 1
            20    6  18 2
            21   18  19 1
            22   19  20 2
            23    4  20 1
            24   20  21 1
            25   10  22 1

» Japanese version

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Drug (1)   
   KEGG DRUG (1)   
Chemical substance (11)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   HSDB (1)   
   MASSBANK (5)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (12)   

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