KEGG   DRUG: Piriprost potassium
Entry
D05499                      Drug                                   

Name
Piriprost potassium (USAN)
Formula
C26H34NO4. K
Exact mass
463.2125
Mol weight
463.6508
Structure
Simcomp
Remark
Chemical structure group: DG02899
Efficacy
Antiasthmatic, Arachidonate 5-lipoxygenase inhibitor
Comment
Prostaglandin derivative
Target
ALOX5 [HSA:240] [KO:K00461]
  Pathway
hsa00590  Arachidonic acid metabolism
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Dioxygenases
    ALOX5
     D05499  Piriprost potassium (USAN)
Other DBs
CAS: 88851-62-1
PubChem: 47207168
ChEMBL: CHEMBL2106944
LigandBox: D05499
LinkDB
KCF data

ATOM        32
            1   Z   K    24.6402  -21.1401 #+
            2   C1x C    14.4200  -26.0400
            3   C1y C    15.1900  -27.2300
            4   C1y C    16.5200  -26.8100
            5   C8y C    16.5200  -25.4100
            6   C8y C    15.1900  -24.9200
            7   C2b C    17.7100  -27.5100
            8   C2b C    18.9000  -26.8100
            9   C1c C    20.0900  -27.5100
            10  C1b C    21.2800  -26.8100
            11  C1b C    22.4700  -27.5100
            12  C1b C    23.6600  -26.8100
            13  C1b C    24.8500  -27.5100
            14  C1a C    26.0400  -26.8100
            15  O1a O    20.0900  -28.9100
            16  O1a O    14.7000  -28.5600
            17  C8x C    17.4300  -24.2900
            18  C8y C    16.5900  -23.1000
            19  N4y N    15.1900  -23.5200
            20  C8y C    14.0700  -22.6800
            21  C8x C    14.0700  -21.2800
            22  C8x C    12.8800  -20.5800
            23  C8x C    11.6200  -21.2800
            24  C8x C    11.6200  -22.6800
            25  C8x C    12.8800  -23.3800
            26  C1b C    17.0800  -21.7700
            27  C1b C    18.2700  -21.0700
            28  C1b C    19.4600  -21.7700
            29  C1b C    20.6500  -21.0700
            30  C6a C    21.8400  -21.7700
            31  O6a O    23.0300  -21.0700 #-
            32  O6a O    21.8400  -23.1700
BOND        33
            1     2   3 1
            2     3   4 1
            3     4   5 1
            4     5   6 2
            5     2   6 1
            6     4   7 1 #Up
            7     7   8 2
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13  14 1
            14    9  15 1 #Down
            15    3  16 1 #Down
            16    5  17 1
            17   17  18 2
            18   18  19 1
            19    6  19 1
            20   19  20 1
            21   20  21 2
            22   21  22 1
            23   22  23 2
            24   23  24 1
            25   24  25 2
            26   20  25 1
            27   18  26 1
            28   27  28 1
            29   27  26 1
            30   28  29 1
            31   29  30 1
            32   30  31 1
            33   30  32 2

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