KEGG   COMPOUND: C08103
Entry
C08103                      Compound                               
Name
Cefmetazole
Formula
C15H17N7O5S3
Exact mass
471.0453
Mol weight
471.5344
Structure
Remark
Same as: D00910
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01D OTHER BETA-LACTAM ANTIBACTERIALS
    J01DC Second-generation cephalosporins
     J01DC09 Cefmetazole
      D00910  Cefmetazole (USP/INN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01714  Cephalosporin skeleton group
    DG01488  Cephem
     DG00565  Cefmetazole
      D00910  Cefmetazole
  DG01775  Second-generation cephalosporin
   DG00565  Cefmetazole
    D00910  Cefmetazole
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Second-generation cephalosporin
    D00910  Cefmetazole (USP/INN)
Other DBs
CAS: 56796-20-4
PubChem: 10303
ChEBI: 3489
PDB-CCD: 4KO[PDBj]
NIKKAJI: J14.542D
KCF data

ATOM        30
            1   C1y C    27.8723  -15.3094
            2   N1y N    27.8723  -16.6803
            3   C2y C    29.0595  -17.3655
            4   C2y C    30.2467  -16.6803
            5   C1x C    30.2467  -15.3094
            6   S2x S    29.0595  -14.6240
            7   C1z C    26.5014  -15.3094
            8   C5x C    26.5014  -16.6803
            9   N1b N    25.3144  -14.6240
            10  C5a C    24.1271  -15.3094
            11  O5a O    24.1271  -16.6803
            12  O5x O    25.3144  -17.3655
            13  C1b C    22.9400  -14.6240
            14  C1b C    31.4520  -17.3765
            15  C6a C    29.0595  -18.7361
            16  O6a O    27.8558  -19.4312
            17  O6a O    30.2300  -19.4120
            18  S2a S    21.7337  -15.3209
            19  C1b C    20.5480  -14.6362
            20  S2a S    32.6439  -16.6885
            21  C8y C    33.8308  -17.3740
            22  N5x N    34.2964  -18.6621
            23  N5x N    35.6675  -18.6905
            24  N5x N    36.0517  -17.3037
            25  N4y N    34.9180  -16.5315
            26  O2a O    26.5014  -13.1156
            27  C1a C    27.6860  -12.4316
            28  C1a C    34.9180  -15.1355
            29  C3b C    19.3287  -15.3399
            30  N3a N    18.1185  -16.0385
BOND        32
            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 2
            13    8  12 2
            14   10  13 1
            15    4  14 1
            16    3  15 1
            17   15  16 2
            18   15  17 1
            19   13  18 1
            20   18  19 1
            21   14  20 1
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   21  25 1
            28    7  26 1 #Down
            29   26  27 1
            30   25  28 1
            31   19  29 1
            32   29  30 3

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