KEGG   DRUG: D08885Help
Entry
D08885                      Drug                                   

Name
Ceftobiprole (USAN/INN)
Formula
C20H22N8O6S2
Exact mass
534.1104
Mol weight
534.5687
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Broad spectrum antibiotic
Comment
Cephalosporin antibiotic
See Ceftobiprole medocaril [DR:D08886]
Target
penicillin-binding protein (PBP) 2A inhibitor [KO:K12555]
  Pathway
ko00550  Peptidoglycan biosynthesis  
 
Brite
Antiinfectives [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor
   Penicillin binding proteins inhibitor
    Cephems - Cephalosporins
     Ceftobiprole
      D08885  Ceftobiprole (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
209467-52-7
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        36
            1   C1y C    16.5900  -18.2700
            2   N1y N    16.5900  -19.6700
            3   C2y C    17.7800  -20.3700
            4   C2y C    19.0400  -19.6700
            5   C1x C    19.0400  -18.2700
            6   S2x S    17.7800  -17.5700
            7   C1y C    15.1900  -18.2700
            8   C5x C    15.1900  -19.6700
            9   N1b N    14.0000  -17.5700
            10  C5a C    12.8100  -18.2700
            11  C2c C    11.6200  -17.5700
            12  O5a O    12.8100  -19.6700
            13  C8y C    10.4300  -18.2700
            14  N2b N    11.6200  -16.1700
            15  O1b O    12.8100  -15.4700
            16  N5x N     9.1000  -17.8500
            17  C8y C     8.2600  -18.9700
            18  S2x S     9.1000  -20.0900
            19  N5x N    10.4300  -19.6700
            20  N1a N     6.8600  -18.9700
            21  O5x O    14.0000  -20.3700
            22  C6a C    17.7800  -21.7700
            23  O6a O    16.5200  -22.4700
            24  O6a O    18.9700  -22.4700
            25  C2b C    20.2300  -20.3700
            26  C2y C    21.4900  -19.6700
            27  C5x C    22.6100  -20.5100
            28  N1y N    23.7300  -19.6700
            29  C1x C    23.3100  -18.3400
            30  C1x C    21.8400  -18.3400
            31  O5x O    22.6100  -21.9100
            32  C1y C    24.9200  -20.3700
            33  C1x C    25.3400  -21.7000
            34  C1x C    26.7400  -21.7000
            35  N1x N    27.1600  -20.3700
            36  C1x C    26.0400  -19.5300
BOND        40
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     2   8 1
            10    7   9 1 #Up
            11    9  10 1
            12   10  11 1
            13   10  12 2
            14   11  13 1
            15   11  14 2
            16   14  15 1
            17   13  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 1
            21   13  19 2
            22   17  20 1
            23    8  21 2
            24    3  22 1
            25   22  23 2
            26   22  24 1
            27    4  25 1
            28   25  26 2
            29   26  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   26  30 1
            34   27  31 2
            35   32  28 1 #Up
            36   32  33 1
            37   33  34 1
            38   34  35 1
            39   35  36 1
            40   32  36 1

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