KEGG   DRUG: D05259Help
Entry
D05259                      Drug                                   

Name
Omeprazole magnesium (USAN);
Prilosec OTC (TN)
Product
Formula
(C17H18N3O3S)2. Mg
Exact mass
712.1988
Mol weight
713.1212
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Gastric and secretory depressant [DS:H00045]
Remark
ATC code: 
Comment
proton pump inhibitor
Target
H+/K+ exchanging, alpha polypeptide inhibitor [HSA:495] [KO:K01542];
H+/K+ exchanging, beta polypeptide inhibitor [HSA:496] [KO:K01543]
  Pathway
hsa00190  Oxidative phosphorylation
hsa04966  Collecting duct acid secretion
hsa04971  Gastric acid secretion  
 
Metabolism
Enzyme: CYP2C19 [HSA:1557], CYP3A4 [HSA:1576]
Interaction
Genomic biomarker: CYP2C19 [HSA:1557]
CYP induction: CYP1A2 [HSA:1544]
CYP inhibition: CYP2C19 [HSA:1557]
Drug interaction
Structure map
Antiulcer drugs
Ion transporter inhibitors
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
      D05259  Omeprazole magnesium (USAN)
USP drug classification [BR:br08302]
 Gastrointestinal Agents
  Proton Pump Inhibitors
   Omeprazole
    D05259  Omeprazole magnesium (USAN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   H+/K+ exchanging, polypeptide [HSA:495 496] [KO:K01542 K01543]
    Omeprazol [ATC:A02BC01]
     D05259  Omeprazole magnesium (USAN)
BRITE hierarchy
Other DBs
CAS: 
95382-33-5
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        49
            1   Z   Mg   39.5425  -21.5845 #2+
            2   C8x C    22.6100  -19.3200
            3   C8y C    22.6100  -20.7200
            4   C8x C    23.8700  -21.4200
            5   C8y C    25.0600  -20.7200
            6   C8y C    25.0600  -19.3200
            7   C8x C    23.8700  -18.6200
            8   N5x N    26.3900  -21.1400
            9   C8y C    27.2300  -20.0200
            10  N4x N    26.3900  -18.9000 #-
            11  S4a S    28.6300  -20.0200
            12  O2a O    21.3500  -21.4200
            13  C1a C    20.1600  -20.7200
            14  C1b C    29.3300  -21.2100
            15  O3c O    29.3300  -18.8300
            16  C8y C    30.7300  -21.2100
            17  C8y C    31.4300  -22.4000
            18  C8y C    32.9000  -22.4000
            19  C8y C    33.6000  -21.2100
            20  C8x C    32.9000  -20.0200
            21  N5x N    31.4300  -20.0200
            22  C1a C    35.0000  -21.2100
            23  O2a O    33.6000  -23.6600
            24  C1a C    35.0000  -23.6600
            25  C1a C    30.7300  -23.5900
            26  C8x C    22.6100  -19.3200
            27  C8y C    22.6100  -20.7200
            28  C8x C    23.8700  -21.4200
            29  C8y C    25.0600  -20.7200
            30  C8y C    25.0600  -19.3200
            31  C8x C    23.8700  -18.6200
            32  N4x N    26.3900  -18.9000 #-
            33  C8y C    27.2300  -20.0200
            34  N5x N    26.3900  -21.1400
            35  S4a S    28.6300  -20.0200
            36  C1b C    29.3300  -21.2100
            37  C8y C    30.7300  -21.2100
            38  C8y C    31.4300  -22.4000
            39  C8y C    32.9000  -22.4000
            40  C8y C    33.6000  -21.2100
            41  C8x C    32.9000  -20.0200
            42  N5x N    31.4300  -20.0200
            43  C1a C    35.0000  -21.2100
            44  O2a O    33.6000  -23.6600
            45  C1a C    35.0000  -23.6600
            46  C1a C    30.7300  -23.5900
            47  O3c O    29.3300  -18.8300
            48  O2a O    21.3500  -21.4200
            49  C1a C    20.1600  -20.7200
BOND        52
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     5   8 1
            8     8   9 2
            9     9  10 1
            10    6  10 1
            11    9  11 1
            12    3  12 1
            13   12  13 1
            14   11  14 1
            15   11  15 2
            16   14  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   16  21 1
            23   19  22 1
            24   18  23 1
            25   23  24 1
            26   17  25 1
            27   26  27 2
            28   27  28 1
            29   28  29 2
            30   29  30 1
            31   30  31 2
            32   26  31 1
            33   29  34 1
            34   34  33 2
            35   33  32 1
            36   30  32 1
            37   33  35 1
            38   27  48 1
            39   48  49 1
            40   35  36 1
            41   35  47 2
            42   36  37 1
            43   37  38 2
            44   38  39 1
            45   39  40 2
            46   40  41 1
            47   41  42 2
            48   37  42 1
            49   40  43 1
            50   39  44 1
            51   44  45 1
            52   38  46 1
BRACKET     1    18.2700  -25.0600   18.2700  -17.1500
            1    37.1700  -17.1500   37.1700  -25.0600
            1  2
 ORIGINAL  1    2   3   4   5   6   7  10   9   8  11  14  16  17  18  19  20
            1   21  22  23  24  25  15  12  13
 REPEAT    1   26  27  28  29  30  31  32  33  34  35  36  37  38  39  40  41
            1   42  43  44  45  46  47  48  49

» Japanese version   » Back

DBGET integrated database retrieval system