KEGG   DRUG: DyphyllineHelp
Entry
D00691                      Drug                                   

Name
Dyphylline (USP);
Diprophylline (JAN/INN);
Lufyllin (TN)
Formula
C10H14N4O4
Exact mass
254.1015
Mol weight
254.2426
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01616  Xanthine derivative
  DG01609  Xanthine-type bronchodilator
Remark
Same as: C07819
Therapeutic category: 2115
ATC code: R03DA01
Product: D00691<JP>
Product (mixture): D04342<JP> D04259<JP> D04261<JP> D04299<JP> D04296<JP> D08695<JP>
Efficacy
Bronchodilator, Cardiotonic, Phosphodiesterase inhibitor
Comment
Xanthine derivative
Target
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
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
     R03DA01 Diprophylline
      D00691  Dyphylline (USP) <JP>
USP drug classification [BR:br08302]
 Respiratory Tract/Pulmonary Agents
  Phosphodiesterase Inhibitors, Airways Disease
   Dyphylline
    D00691  Dyphylline (USP)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   211  Cardiotonics
    2115  Caffeines
     D00691  Dyphylline (USP); Diprophylline (JAN/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for respiratory organs
  26 Antitussives and expectorants
   D00691  Dyphylline (USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Diprophylline
    D00691  Dyphylline (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adenosine
    ADORA1
     D00691  Dyphylline (USP) <JP>
    ADORA2B
     D00691  Dyphylline (USP) <JP>
 Enzymes
  Hydrolases (EC3)
   Phosphodiesterase
    PDE
     D00691  Dyphylline (USP) <JP>
Drug classes of therapeutic agents [br08360.html]
 Respiratory agents
  D00691
BRITE hierarchy
Other DBs
CAS: 479-18-5
PubChem: 7847757
ChEBI: 4728
ChEMBL: CHEMBL1752
DrugBank: DB00651
LigandBox: D00691
NIKKAJI: J2.054K
LinkDB All DBs
KCF data Show

ATOM        18
            1   C8y C    28.1400  -17.7100
            2   C8y C    28.1400  -19.1100
            3   N4y N    26.8100  -17.2900
            4   C8y C    29.3300  -17.0100
            5   N4y N    29.3300  -19.8100
            6   N5x N    26.8100  -19.6000
            7   C1b C    25.6200  -16.5900
            8   C8x C    25.9700  -18.4800
            9   N4y N    30.5900  -17.7100
            10  O5x O    29.3300  -15.6100
            11  C8y C    30.5900  -19.1100
            12  C1a C    29.3300  -21.2800
            13  C1c C    24.4300  -17.2900
            14  C1a C    31.7800  -17.0100
            15  O5x O    31.7800  -19.8100
            16  C1b C    23.1700  -16.5900
            17  O1a O    24.4300  -18.6900
            18  O1a O    21.9800  -17.2900
BOND        19
            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 1
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    5  12 1
            12    7  13 1
            13    9  14 1
            14   11  15 2
            15   13  16 1
            16   13  17 1
            17   16  18 1
            18    6   8 2
            19    9  11 1

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