KEGG   DRUG: D00371Help
Entry
D00371                      Drug                                   

Name
Theophylline (JP16);
Elixophyllin (TN);
Quibron-t (TN);
Theo-24 (TN);
Theodur G (TN);
Theolair (TN);
Uniphyl (TN)
Product
  Generic
THEOPHYLLINE (A-S Medication Solutions LLC), THEOPHYLLINE (Alembic Pharmaceuticals Limited), THEOPHYLLINE (Bryant Ranch Prepack), THEOPHYLLINE (Bryant Ranch Prepack), THEOPHYLLINE (Bryant Ranch Prepack), THEOPHYLLINE (Cardinal Health), THEOPHYLLINE (Carilion Materials Management), THEOPHYLLINE (Clinical Solutions Wholesale), THEOPHYLLINE (Glenmark Generics), THEOPHYLLINE (Heritage Pharmaceuticals), THEOPHYLLINE (Lake Erie Medical DBA Quality Care Products LLC), THEOPHYLLINE (Lake Erie Medical DBA Quality Care Products LLC), THEOPHYLLINE (Liberta Pharma), THEOPHYLLINE (Major Pharmaceuticals), THEOPHYLLINE (Nostrum Laboratories), THEOPHYLLINE(ANHYDROUS) (PACK Pharmaceuticals), THEOPHYLLINE (Physicians Total Care), THEOPHYLLINE (Pliva), THEOPHYLLINE (REMEDYREPACK), THEOPHYLLINE (REMEDYREPACK), THEOPHYLLINE (Rhodes Pharmaceuticals L.P.), THEOPHYLLINE (Silarx Pharmaceuticals), THEOPHYLLINE (State of Florida DOH Central Pharmacy), THEOPHYLLINE (State of Florida DOH Central Pharmacy), THEOPHYLLINE (Tris Pharma), ELIXOPHYLLIN (Atlantic Biologicals Corps), ELIXOPHYLLIN (Caraco Pharma), THEOPHYLLINE (Pharmaceutical Associates), UNIPHYL (Purdue Pharmaceutical Products LP), THEO-24 (UCB), THEO-24 (Cardinal Health), THEOPHYLLINE EXTENDED RELEASE (NCS HealthCare of KY), THEOPHYLLINE EXTENDED RELEASE (NCS HealthCare of KY)
Formula
C7H8N4O2
Exact mass
180.0647
Mol weight
180.164
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Bronchodilator [DS:H00079]
Remark
Same as: 
Therapeutic category: 
ATC code: 
Drug group: 
Comment
Xanthines
Target
adenosine A1 receptor antagonist [HSA:134] [KO:K04265];
adenosine A2a receptor antagonist [HSA:135] [KO:K04266];
phosphodiesterase (PDE) inhibitor [HSA:10846 27115 50940 5136 5137 5138 5139 5140 5141 5142 5143 5144 5150 5151 5153 8622] [KO:K18438 K18436 K13298 K13755 K18283 K13296 K13293 K18437]
  Pathway
hsa00230  Purine metabolism
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction  
 
Metabolism
Enzyme: CYP1A2 [HSA:1544], CYP2E1 [HSA:1571]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R03 DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
   R03D OTHER SYSTEMIC DRUGS FOR OBSTRUCTIVE AIRWAY DISEASES
    R03DA Xanthines
     R03DA04 Theophylline
      D00371  Theophylline (JP16)
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Phosphodiesterase Inhibitors, Airways Disease
   Theophylline
    D00371  Theophylline (JP16)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  22  Respiratory organ agents
   225  Bronchodilators
    2251  Xanthines
     D00371  Theophylline (JP16)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for respiratory organs
  26 Antitussives and expectorants
   D00371  Theophylline (JP16)
Risk category of Japanese OTC drugs [BR:br08312]
 First-class OTC drugs
  Inorganic and organic chemicals
   Theophylline
    D00371  Theophylline (JP16)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adenosine
    adenosine A1 receptor
     Theophylline
      D00371  Theophylline (JP16)
    adenosine A2a receptor
     Theophylline
      D00371  Theophylline (JP16)
 Enzymes
  Hydrolases
   phosphodiesterase (PDE)
    Theophylline
     D00371  Theophylline (JP16)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP1A2
   Theophylline
    D00371  Theophylline (JP16)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00371  Theophylline
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Others
   Purine alkaloids
    D00371  Theophylline (JP15)
BRITE hierarchy
Other DBs
CAS: 
58-55-9
PubChem: 
DrugBank: 
PDB-CCD: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        13
            1   C8y C    24.1848  -17.2082
            2   C8y C    24.1848  -18.6318
            3   C8y C    25.3867  -16.5023
            4   N4x N    22.8837  -16.7764
            5   N4y N    25.3867  -19.3144
            6   N5x N    22.8837  -19.0636
            7   N4y N    26.6061  -17.2374
            8   O5x O    25.3867  -15.1253
            9   C8x C    22.0669  -17.9317
            10  C8y C    26.6061  -18.5794
            11  C1a C    25.3867  -20.7440
            12  C1a C    27.8547  -16.5606
            13  O5x O    27.8547  -19.2794
BOND        14
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    7  12 1
            12   10  13 2
            13    6   9 2
            14    7  10 1

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