KEGG   DRUG: D09362Help
Entry
D09362                      Drug                                   

Name
Otenabant (USAN/INN)
Formula
C25H25Cl2N7O
Exact mass
509.1498
Mol weight
510.4183
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of obesity
Target
cannabinoid receptor 1 (brain) agonist [HSA:1268] [KO:K04277]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Cannabinoid
    cannabinoid receptor 1 [HSA:1268] [KO:K04277]
     Otenabant
      D09362  Otenabant (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
686344-29-6
PubChem: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        35
            1   C8x C    13.5100  -19.2500
            2   N5x N    13.5100  -20.6500
            3   C8y C    14.7224  -21.3500
            4   C8y C    15.9349  -20.6500
            5   C8y C    15.9349  -19.2500
            6   N5x N    14.7224  -18.5500
            7   N5x N    17.2664  -21.0826
            8   C8y C    18.0893  -19.9500
            9   N4y N    17.2664  -18.8174
            10  C8y C    19.4600  -19.9500
            11  C8y C    20.1600  -21.1624
            12  C8x C    21.5600  -21.1624
            13  C8x C    22.2600  -19.9500
            14  C8x C    21.5600  -18.7376
            15  C8x C    20.1600  -18.7376
            16  X   Cl   19.4696  -22.3579
            17  C8y C    17.6975  -17.4906
            18  C8x C    19.0769  -17.1974
            19  C8x C    19.5095  -15.8660
            20  C8y C    18.5728  -14.8256
            21  C8x C    17.1934  -15.1187
            22  C8x C    16.7608  -16.4502
            23  X   Cl   18.9987  -13.5139
            24  N1y N    14.7224  -22.7498
            25  C1x C    13.4932  -23.4597
            26  C1x C    13.4934  -24.8597
            27  C1z C    14.7059  -25.5596
            28  C1x C    15.9351  -24.8497
            29  C1x C    15.9349  -23.4497
            30  N1b N    14.0059  -26.7720
            31  C5a C    15.4059  -26.7720
            32  N1a N    16.8059  -26.7720
            33  O5a O    14.8580  -28.1027
            34  C1b C    12.6059  -26.7720
            35  C1a C    11.8904  -25.5332
BOND        39
            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     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12   10  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   10  15 1
            18   11  16 1
            19    9  17 1
            20   17  18 2
            21   18  19 1
            22   19  20 2
            23   20  21 1
            24   21  22 2
            25   17  22 1
            26   20  23 1
            27    3  24 1
            28   24  25 1
            29   25  26 1
            30   26  27 1
            31   27  28 1
            32   28  29 1
            33   24  29 1
            34   27  30 1
            35   27  31 1
            36   31  32 1
            37   31  33 2
            38   30  34 1
            39   34  35 1

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