KEGG   DRUG: D02861Help
Entry
D02861                      Drug                                   

Name
Indinavir sulfate ethanolate (JAN);
Crixivan (TN)
Formula
C36H47N5O4. H2SO4. C2H6O
Exact mass
757.372
Mol weight
757.9364
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antiviral [DS:H00406]
Remark
Therapeutic category: 
ATC code: 
Drug group: 
Target
HIV protease inhibitor [CPD:C19849]
Metabolism
Enzyme: CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551]
Interaction
CYP inhibition: CYP3A4 [HSA:1576], CYP3A5 [HSA:1577], CYP3A7 [HSA:1551]
Drug interaction
Structure map
Anti-HIV agents
HIV protease inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J05 ANTIVIRALS FOR SYSTEMIC USE
   J05A DIRECT ACTING ANTIVIRALS
    J05AE Protease inhibitors
     J05AE02 Indinavir
      D02861  Indinavir sulfate ethanolate (JAN)
USP drug classification [BR:br08302]
 Antivirals
  Anti-HIV Agents, Protease Inhibitors
   Indinavir
    D02861  Indinavir sulfate ethanolate (JAN)
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  62  Chemotherapeutics
   625  Antivirals
    6250  Antivirals
     D02861  Indinavir sulfate ethanolate (JAN)
Antiinfectives [BR:br08307]
 Antivirals
  Anti-HIV agents
   Protease inhibitor (PIs)
    Peptidic
     Indinavir
      D02861  Indinavir sulfate ethanolate (JAN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Indinavir
    D02861  Indinavir sulfate ethanolate (JAN)
  CYP3A5
   Indinavir
    D02861  Indinavir sulfate ethanolate (JAN)
  CYP3A7
   Indinavir
    D02861  Indinavir sulfate ethanolate (JAN)
 Inhbitors
  CYP3A
   Indinavir
    D02861  Indinavir sulfate ethanolate (JAN)
BRITE hierarchy
Other DBs
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        53
            1   C8y C    17.8500  -17.7100
            2   C1y C    18.9000  -16.7300
            3   C8y C    16.6600  -17.0100
            4   C8x C    17.8500  -19.1100
            5   C1y C    18.3400  -15.4000
            6   N1b N    20.0900  -17.5000
            7   C1x C    16.9400  -15.5400
            8   C8x C    15.4700  -17.7100
            9   C8x C    16.6600  -19.8100
            10  O1a O    19.0400  -14.2100
            11  C5a C    21.4200  -16.7300
            12  C8x C    15.4700  -19.1100
            13  C1c C    22.6100  -17.4300
            14  O5a O    21.4200  -15.2600
            15  C1b C    22.6100  -18.8300
            16  C1b C    23.8700  -16.7300
            17  C8y C    21.4200  -19.5300
            18  C1c C    25.0600  -17.4300
            19  C8x C    21.4200  -20.9300
            20  C8x C    20.2300  -18.8300
            21  C1b C    26.2500  -16.7300
            22  O1a O    25.0600  -18.8300
            23  C8x C    20.2300  -21.6300
            24  C8x C    19.0400  -19.5300
            25  N1y N    27.5100  -17.4300
            26  C8x C    19.0400  -20.9300
            27  C1y C    28.7000  -16.7300
            28  C1x C    27.5100  -18.8300
            29  C1x C    29.8900  -17.4300
            30  C5a C    28.7000  -15.2600
            31  C1x C    28.7000  -19.5300
            32  N1y N    29.8900  -18.8300
            33  N1b N    29.8900  -14.5600
            34  O5a O    27.5100  -14.5600
            35  C1b C    31.1500  -19.5300
            36  C1d C    31.1500  -15.2600
            37  C8y C    32.3400  -18.8300
            38  C1a C    32.4100  -16.0300
            39  C1a C    30.5200  -16.2400
            40  C1a C    31.7800  -14.0700
            41  C8x C    32.3400  -17.4300
            42  C8x C    33.5300  -19.5300
            43  C8x C    33.5300  -16.7300
            44  N5x N    34.7900  -18.8300
            45  C8x C    34.7900  -17.4300
            46  S4a S    24.2900  -22.8900
            47  O1d O    22.8900  -22.8900
            48  O1d O    25.6900  -22.8900
            49  O1d O    24.2900  -21.4900
            50  O1d O    24.2900  -24.2900
            51  C1a C    17.0100  -22.8900
            52  C1b C    18.2700  -22.1900
            53  O1a O    19.4600  -22.8900
BOND        55
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1 #Up
            10    6  11 1
            11    8  12 2
            12   11  13 1
            13   11  14 2
            14   13  15 1 #Up
            15   13  16 1
            16   15  17 1
            17   16  18 1
            18   17  19 2
            19   17  20 1
            20   18  21 1
            21   18  22 1 #Up
            22   19  23 1
            23   20  24 2
            24   21  25 1
            25   23  26 2
            26   25  27 1
            27   25  28 1
            28   27  29 1
            29   27  30 1 #Down
            30   28  31 1
            31   29  32 1
            32   30  33 1
            33   30  34 2
            34   32  35 1
            35   33  36 1
            36   35  37 1
            37   36  38 1
            38   36  39 1
            39   36  40 1
            40   37  41 1
            41   37  42 2
            42   41  43 2
            43   42  44 1
            44   43  45 1
            45    5   7 1
            46    9  12 1
            47   24  26 1
            48   31  32 1
            49   44  45 2
            50   46  47 1
            51   46  48 1
            52   46  49 2
            53   46  50 2
            54   51  52 1
            55   52  53 1

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