KEGG   COMPOUND: C06963Help
Entry
C06963                      Compound                               

Name
Dipivefrin;
Dipivefrine
Formula
C19H29NO5
Exact mass
351.2046
Mol weight
351.4373
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EA Sympathomimetics in glaucoma therapy
     S01EA02 Dipivefrine
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
USP drug classification [BR:br08302]
 Ophthalmic Agents
  Ophthalmic Antiglaucoma Agents
   Dipivefrin
    D02349  Dipivefrin (USAN); Dipivefrine (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha1-adrenergic receptor
     Dipivefrine
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
    alpha2-adrenergic receptor
     Dipivefrine
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
    beta1-adrenergic receptor
     Dipivefrine
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
    beta2-adrenergic receptor
     Dipivefrine
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
    beta3-adrenergic receptor
     Dipivefrin
      D02349  Dipivefrin (USAN); Dipivefrine (INN)
BRITE hierarchy
Other DBs
CAS: 
52365-63-6
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C8y C    21.7584  -17.0566
            2   C8y C    22.9716  -16.3569
            3   C8x C    21.7584  -18.4506
            4   O7a O    20.5511  -16.3569
            5   C8x C    24.1730  -17.0566
            6   O7a O    22.9716  -14.9629
            7   C8y C    22.9716  -19.1505
            8   C7a C    19.3438  -17.0566
            9   C8x C    24.1730  -18.4506
            10  C7a C    24.1847  -14.2689
            11  C1c C    22.9716  -20.5444
            12  C1d C    18.1367  -16.3569
            13  O6a O    19.3438  -18.4506
            14  C1d C    25.3920  -14.9688
            15  O6a O    24.1847  -12.8691
            16  C1b C    24.1847  -21.2385
            17  O1a O    21.7643  -21.2443
            18  C1a C    16.9235  -17.0509
            19  C1a C    18.0958  -15.0853
            20  C1a C    18.0958  -18.1123
            21  C1a C    26.6343  -14.2396
            22  C1a C    25.4386  -16.1411
            23  C1a C    25.4327  -13.1023
            24  N1b N    25.3920  -20.5386
            25  C1a C    26.5993  -21.2385
BOND        25
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     6  10 1
            10    7  11 1
            11    8  12 1
            12    8  13 2
            13   10  14 1
            14   10  15 2
            15   11  16 1
            16   11  17 1
            17   12  18 1
            18   12  19 1
            19   12  20 1
            20   14  21 1
            21   14  22 1
            22   14  23 1
            23   16  24 1
            24   24  25 1
            25    7   9 2

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