KEGG   DRUG: Ceftiofur hydrochloride
Entry
D03430                      Drug                                   
Name
Ceftiofur hydrochloride (USAN)
Formula
C19H17N5O7S3. HCl
Exact mass
559.0057
Mol weight
560.0235
Structure
Simcomp
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01714  Cephalosporin skeleton group
   DG01488  Cephem
 DG01804  Oxyimino beta-lactam
Remark
Chemical structure group: DG01434
Efficacy
Antibacterial (veterinary), Cell wall biosynthesis inhibitor
Comment
Cephalosporins
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01714  Cephalosporin skeleton group
    DG01488  Cephem
     DG01434  Ceftiofur
      D03430  Ceftiofur hydrochloride
  DG01804  Oxyimino beta-lactam
   DG01434  Ceftiofur
    D03430  Ceftiofur hydrochloride
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Other cephalosporin
    D03430  Ceftiofur hydrochloride (USAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01714  Cephalosporin skeleton group
    DG01488  Cephem
     DG01434  Ceftiofur
  DG01804  Oxyimino beta-lactam
   DG01434  Ceftiofur
Other DBs
CAS: 103980-44-5
PubChem: 17397570
LigandBox: D03430
KCF data

ATOM        35
            1   X   Cl   18.9419  -22.5693
            2   C1y C    24.9542  -18.8125
            3   N1y N    24.9542  -20.2046
            4   C2y C    26.1600  -20.9006
            5   C2y C    27.3656  -20.2046
            6   C1x C    27.3656  -18.8125
            7   S2x S    26.1600  -18.1164
            8   C1y C    23.5619  -18.8125
            9   C5x C    23.5619  -20.2046
            10  N1b N    22.3565  -18.1164
            11  C5a C    21.1507  -18.8125
            12  O5a O    21.1507  -20.2046
            13  O5x O    22.3565  -20.9006
            14  C2c C    19.9450  -18.1164
            15  C1b C    28.5898  -20.9118
            16  C8y C    18.7201  -18.8240
            17  C8x C    17.5872  -17.9918
            18  S2x S    16.4409  -18.8106
            19  C8y C    16.8654  -20.2237
            20  N5x N    18.2739  -20.2352
            21  N2b N    19.9449  -16.7028
            22  C6a C    26.1600  -22.3095
            23  O6a O    27.3763  -23.0117
            24  O6a O    24.9453  -23.0109
            25  S2a S    29.7637  -20.2348
            26  C5a C    30.9669  -20.9302
            27  C8y C    32.1521  -20.2468
            28  C8x C    32.1521  -18.8459
            29  O2x O    33.4843  -20.6797
            30  C8x C    34.3077  -19.5463
            31  C8x C    33.4843  -18.4131
            32  N1a N    16.0600  -21.3544
            33  O5a O    30.9666  -22.3152
            34  O2a O    21.1492  -16.0076
            35  C1a C    21.1492  -14.6076
BOND        37
            1     2   3 1
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 1
            6     2   7 1
            7     2   8 1
            8     8   9 1
            9     3   9 1
            10    8  10 1 #Up
            11   10  11 1
            12   11  12 2
            13    9  13 2
            14   11  14 1
            15    5  15 1
            16   14  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 1
            20   19  20 2
            21   16  20 1
            22   14  21 2
            23    4  22 1
            24   22  23 1
            25   22  24 2
            26   15  25 1
            27   25  26 1
            28   26  27 1
            29   27  28 2
            30   27  29 1
            31   29  30 1
            32   30  31 2
            33   28  31 1
            34   19  32 1
            35   26  33 2
            36   21  34 1
            37   34  35 1

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