KEGG   DRUG: Clometocillin
Entry
D07236                      Drug                                   
Name
Clometocillin (INN)
Formula
C17H18Cl2N2O5S
Exact mass
432.0313
Mol weight
433.3062
Structure
Simcomp
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01713  Penicillin skeleton group
   DG01480  Penicillin
 DG01778  beta-Lactamase sensitive penicillin
Remark
ATC code: J01CE07
Chemical structure group: DG00539
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
    J01CE Beta-lactamase sensitive penicillins
     J01CE07 Clometocillin
      D07236  Clometocillin (INN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     DG00539  Clometocillin
      D07236  Clometocillin
  DG01778  beta-Lactamase sensitive penicillin
   DG00539  Clometocillin
    D07236  Clometocillin
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   beta-Lactamase sensitive penicillin
    D07236  Clometocillin (INN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     DG00539  Clometocillin
  DG01778  beta-Lactamase sensitive penicillin
   DG00539  Clometocillin
Other DBs
CAS: 1926-49-4
PubChem: 51091574
ChEBI: 131732
LigandBox: D07236
NIKKAJI: J7.818B
KCF data

ATOM        27
            1   C1y C    28.7000  -17.6400
            2   C1y C    30.1000  -17.6400
            3   N1y N    30.1000  -19.0400
            4   C5x C    28.7000  -19.0400
            5   S2x S    31.3600  -17.2200
            6   C1z C    32.2000  -18.3400
            7   C1y C    31.4300  -19.4600
            8   C6a C    31.8500  -20.7900
            9   C8y C    21.3500  -19.0400
            10  C8y C    21.3500  -17.6400
            11  C8x C    22.6100  -16.9400
            12  C8y C    23.8000  -17.6400
            13  C8x C    23.8000  -19.0400
            14  C8x C    22.6100  -19.7400
            15  C1c C    25.0600  -16.9400
            16  C5a C    26.2500  -17.6400
            17  N1b N    27.5100  -16.9400
            18  C1a C    33.6000  -18.6900
            19  C1a C    33.0400  -17.1500
            20  O6a O    33.1800  -21.0700
            21  O6a O    30.9400  -21.9100
            22  X   Cl   20.1600  -19.7400
            23  X   Cl   20.1600  -16.9400
            24  O2a O    25.0600  -15.5400
            25  C1a C    26.2500  -14.9100
            26  O5a O    26.2500  -19.0400
            27  O5x O    27.7200  -20.0900
BOND        29
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     2   5 1
            6     5   6 1
            7     6   7 1
            8     3   7 1
            9     7   8 1 #Down
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15    9  14 1
            16   12  15 1
            17   15  16 1
            18   16  17 1
            19    1  17 1 #Up
            20    6  18 1
            21    6  19 1
            22    8  20 1
            23    8  21 2
            24    9  22 1
            25   10  23 1
            26   15  24 1
            27   24  25 1
            28   16  26 2
            29    4  27 2

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