KEGG   COMPOUND: C01690Help
Entry
C01690                      Compound                               

Name
Diclofenac
Formula
C14H11Cl2NO2
Exact mass
295.0167
Mol weight
296.1486
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D11 OTHER DERMATOLOGICAL PREPARATIONS
   D11A OTHER DERMATOLOGICAL PREPARATIONS
    D11AX Other dermatologicals
     D11AX18 Diclofenac
      D07816  Diclofenac (INN)
 M MUSCULO-SKELETAL SYSTEM
  M01 ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
   M01A ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
    M01AB Acetic acid derivatives and related substances
     M01AB05 Diclofenac
      D07816  Diclofenac (INN)
  M02 TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
   M02A TOPICAL PRODUCTS FOR JOINT AND MUSCULAR PAIN
    M02AA Antiinflammatory preparations, non-steroids for topical use
     M02AA15 Diclofenac
      D07816  Diclofenac (INN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BC Antiinflammatory agents, non-steroids
     S01BC03 Diclofenac
      D07816  Diclofenac (INN)
USP drug classification [BR:br08302]
 Analgesics
  Nonsteroidal Anti-inflammatory Drugs
   Diclofenac
    D07816  Diclofenac (INN)
 Anti-inflammatory Agents
  Nonsteroidal Anti-inflammatory Drugs
   Diclofenac
    D07816  Diclofenac (INN)
 Dermatological Agents
  Diclofenac
   D07816  Diclofenac (INN)
 Ophthalmic Agents
  Ophthalmic Anti-inflammatories
   Diclofenac
    D07816  Diclofenac (INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Diclofenac
    D07816  Diclofenac (INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases
   cyclooxygenase-1 (COX-1)
    Diclofenac
     D07816  Diclofenac (INN)
   cyclooxygenase-2 (COX-2)
    Diclofenac
     D07816  Diclofenac (INN)
Cytochrome P450 interactions [BR:br08309]
 CYP substrates
  CYP2C9
   Diclofenac
    D07816  Diclofenac (INN)
 Transporter inhibitors
  ABCC4
   Diclofenac
    D07816  Diclofenac (INN)
  OAT3
   Diclofenac
    D07816  Diclofenac (INN)
 Transporter substrates
  ABCC2
   Diclofenac
    D07816  Diclofenac (INN)
Antirheumatic and antigout drugs [br08366.html]
 Antirheumatic drugs
  D07816
Anesthetics and analgesics [br08369.html]
 Analgesics
  D07816
BRITE hierarchy
Other DBs
CAS: 
15307-86-5
PubChem: 
ChEBI: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        19
            1   C8x C    26.2972  -26.1573
            2   C8x C    26.2972  -27.5565
            3   C8x C    27.5089  -28.2561
            4   C8x C    28.7206  -27.5565
            5   C8y C    28.7206  -26.1573
            6   C8y C    27.5089  -25.4578
            7   C1b C    29.9510  -25.4468
            8   C6a C    31.1554  -26.1420
            9   O6a O    32.3370  -25.4597
            10  O6a O    31.1558  -27.5561
            11  N1b N    27.5089  -24.0588
            12  C8y C    26.2804  -23.3494
            13  C8y C    26.2807  -21.9600
            14  C8x C    25.0692  -21.2602
            15  C8x C    23.8573  -21.9595
            16  C8x C    23.8570  -23.3489
            17  C8y C    25.0686  -24.0487
            18  X   Cl   27.5049  -21.2534
            19  X   Cl   25.0686  -25.4575
BOND        20
            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     5   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 2
            11    6  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   13  18 1
            20   17  19 1

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