KEGG   COMPOUND: C07062
Entry
C07062                      Compound                               
Name
Ketorolac
Formula
C15H13NO3
Exact mass
255.0895
Mol weight
255.2686
Structure
Remark
Same as: D08104
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 M MUSCULO-SKELETAL SYSTEM
  M01 ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS
   M01A ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS, NON-STEROIDS
    M01AB Acetic acid derivatives and related substances
     M01AB15 Ketorolac
      D08104  Ketorolac (INN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BC Antiinflammatory agents, non-steroids
     S01BC05 Ketorolac
      D08104  Ketorolac (INN)
Drug groups [BR:br08330]
 Anti-inflammatory
  DG01504  Nonsteroidal anti-inflammatory drug (NSAID)
   DG01906  Anti-inflammatory drug, acetic acid derivatives
    DG00751  Ketorolac
     D08104  Ketorolac
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Prostaglandin synthase
    PTGS1 (COX1)
     D08104  Ketorolac (INN)
    PTGS2 (COX2)
     D08104  Ketorolac (INN)
Other DBs
CAS: 74103-06-3
PubChem: 9274
ChEBI: 6129
NIKKAJI: J276.267F
KCF data

ATOM        19
            1   N4y N    22.8900  -20.7900
            2   C8y C    24.0100  -21.6300
            3   C8y C    21.7700  -21.7000
            4   C1x C    23.3100  -19.4600
            5   C1y C    25.1300  -20.7900
            6   C8x C    23.5900  -22.9600
            7   C5a C    20.5100  -20.9300
            8   C8x C    22.1900  -22.9600
            9   C1x C    24.6400  -19.4600
            10  C6a C    26.3200  -21.4900
            11  C8y C    19.3200  -21.7000
            12  O5a O    20.5100  -19.5300
            13  O6a O    27.5800  -20.7900
            14  O6a O    26.3200  -22.8900
            15  C8x C    19.3200  -23.1000
            16  C8x C    18.1300  -21.0000
            17  C8x C    18.1300  -23.8000
            18  C8x C    16.9400  -21.7000
            19  C8x C    16.9400  -23.1000
BOND        21
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1
            10    7  11 1
            11    7  12 2
            12   10  13 1
            13   10  14 2
            14   11  15 2
            15   11  16 1
            16   15  17 1
            17   16  18 2
            18   17  19 2
            19    5   9 1
            20    6   8 1
            21   18  19 1

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