KEGG   COMPOUND: C07324Help
Entry
C07324                      Compound                               

Name
Omeprazole
Formula
C17H19N3O3S
Exact mass
345.1147
Mol weight
345.4161
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BC Proton pump inhibitors
     A02BC01 Omeprazole
      D00455  Omeprazole (JP16/USP/INN)
USP drug classification [BR:br08302]
 Gastrointestinal Agents
  Proton Pump Inhibitors
   Omeprazole
    D00455  Omeprazole (JP16/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  23  Digestive organ agents
   232  Peptic ulcer agents
    2329  Others
     D00455  Omeprazole (JP16/USP/INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   H+/K+ exchanging, polypeptide
    Omeprazol
     D00455  Omeprazole (JP16/USP/INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP2C19
   Omeprazole
    D00455  Omeprazole (JP16/USP/INN)
  CYP3A4
   Omeprazole
    D00455  Omeprazole (JP16/USP/INN)
 Inhbitors
  CYP2C19
   Omeprazole
    D00455  Omeprazole (JP16/USP/INN)
 Inducers
  CYP1A2
   Omeprazole
    D00455  Omeprazole (JP16/USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00455  Omeprazole
  D00455  Omeprazole enteric-coated tablets
Animal drugs in Japan [BR:br08331]
 93  Agents affecting digestive organs
  931  Stomachics, digestive and antacids
   9319  Other stomachics, digestive and antacids
    C07324  Omeprazole
BRITE hierarchy
Other DBs
CAS: 
73590-58-6
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C8x C    22.6800  -19.3200
            2   C8y C    22.6800  -20.7200
            3   C8x C    23.8700  -21.4200
            4   C8y C    25.0600  -20.7200
            5   C8y C    25.0600  -19.3200
            6   C8x C    23.8700  -18.6200
            7   N5x N    26.3900  -21.1400
            8   C8y C    27.2300  -20.0200
            9   N4x N    26.3900  -18.9000
            10  S4a S    28.6300  -20.0200
            11  O2a O    21.4200  -21.4200
            12  C1a C    20.2300  -20.7200
            13  C1b C    29.3300  -21.2100
            14  O3c O    29.3300  -18.8300
            15  C8y C    30.7300  -21.2100
            16  C8y C    31.4300  -22.4000
            17  C8y C    32.8300  -22.4000
            18  C8y C    33.5300  -21.2100
            19  C8x C    32.8300  -20.0200
            20  N5x N    31.4300  -20.0200
            21  C1a C    34.9300  -21.2100
            22  O2a O    33.5300  -23.6600
            23  C1a C    34.9300  -23.6600
            24  C1a C    30.7300  -23.5900
BOND        26
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12    2  11 1
            13   11  12 1
            14   10  13 1
            15   10  14 2
            16   13  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   15  20 1
            23   18  21 1
            24   17  22 1
            25   22  23 1
            26   16  24 1

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