KEGG   DRUG: D03971Help
Entry
D03971                      Drug                                   

Name
Elarofiban (USAN)
Formula
C22H32N4O4. H2O
Exact mass
434.2529
Mol weight
434.5292
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of thrombotic disorders [platelet fibrinogen receptor [GPIIb/IIIa] antagonist]
Target
glycoprotein alphaIIb/beta3 (GPIIb/IIIa) receptor antagonist [HSA:3674 3690] [KO:K06476 K06493]
  Pathway
hsa04510  Focal adhesion
hsa04512  ECM-receptor interaction  
 
Brite
Target-based classification of drugs [BR:br08310]
 Others
  Cell adhesion molecules (CAMs)
   glycoprotein alpha IIb/beta3 (GPIIb/IIIa) receptor
    Elarofiban
     D03971  Elarofiban (USAN)
BRITE hierarchy
Other DBs
CAS: 
221005-96-5
PubChem: 
LigandBox: 
KCF data Show

ATOM        31
            1   C1x C     9.8000  -16.2400
            2   N1x N     9.8000  -17.6400
            3   C1x C    11.0124  -18.3400
            4   C1x C    12.2249  -17.6400
            5   C1y C    12.2249  -16.2400
            6   C1x C    11.0124  -15.5400
            7   C1b C    13.4560  -15.5290
            8   C1b C    14.6612  -16.2247
            9   C5a C    15.8435  -15.5419
            10  N1y N    17.0375  -16.2312
            11  O5a O    15.8435  -14.1402
            12  C1x C    17.0376  -17.6397
            13  C1x C    18.2501  -18.3396
            14  C1x C    19.4625  -17.6395
            15  C1y C    19.4623  -16.2309
            16  C1x C    18.2498  -15.5311
            17  C5a C    20.6690  -15.5341
            18  N1b N    21.8697  -16.2273
            19  O5a O    20.6689  -14.1401
            20  C1c C    23.0543  -15.5433
            21  C1b C    24.2470  -16.2320
            22  C6a C    25.4357  -15.5457
            23  C8y C    23.0544  -14.1402
            24  C8x C    24.2485  -13.4506
            25  N5x N    24.2484  -12.0506
            26  C8x C    23.0359  -11.3507
            27  C8x C    21.8417  -12.0403
            28  C8x C    21.8419  -13.4403
            29  O6a O    26.6263  -16.2332
            30  O6a O    25.4358  -14.1402
            31  O0  O    24.2900  -19.0400
BOND        32
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    9  11 2
            12   10  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   10  16 1
            18   15  17 1 #Down
            19   17  18 1
            20   17  19 2
            21   18  20 1
            22   20  21 1
            23   21  22 1
            24   20  23 1 #Down
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   26  27 1
            29   27  28 2
            30   23  28 1
            31   22  29 1
            32   22  30 2

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