KEGG   COMPOUND: C07761Help
Entry
C07761                      Compound                               

Name
Cephalothin;
Cefalotin
Formula
C16H16N2O6S2
Exact mass
396.045
Mol weight
396.438
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01D OTHER BETA-LACTAM ANTIBACTERIALS
    J01DB First-generation cephalosporins
     J01DB03 Cefalotin
      D07635  Cefalotin (BAN)
Antiinfectives [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor
   Penicillin binding proteins inhibitor
    Cephem
     First-generation cephalosporin
      Cefalotin
       D07635  Cefalotin (BAN)
BRITE hierarchy
Other DBs
CAS: 
153-61-7
PubChem: 
ChEBI: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   C1y C    27.7355  -14.5897
            2   N1y N    27.7355  -15.9867
            3   C2y C    28.9454  -16.6852
            4   C2y C    30.1554  -15.9867
            5   C1x C    30.1554  -14.5897
            6   S2x S    28.9454  -13.8913
            7   C1y C    26.3384  -14.5897
            8   C5x C    26.3384  -15.9867
            9   N1b N    25.1287  -13.8913
            10  C5a C    23.9187  -14.5897
            11  O5a O    23.9187  -15.9867
            12  O5x O    25.1287  -16.6852
            13  C1b C    22.7088  -13.8913
            14  C1b C    31.3838  -16.6963
            15  C6a C    28.9454  -18.0822
            16  O6a O    27.7188  -18.7905
            17  O6a O    30.1384  -18.7710
            18  C8y C    21.4795  -14.6014
            19  O7a O    32.5986  -15.9951
            20  C7a C    33.8093  -16.6941
            21  C1a C    35.0199  -15.9951
            22  S2x S    20.3320  -13.8045
            23  C8x C    19.2177  -14.6495
            24  C8x C    19.6770  -15.9705
            25  C8x C    21.0752  -15.9418
            26  O6a O    33.8097  -18.1169
BOND        28
            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   14  19 1
            21   19  20 1
            22   20  21 1
            23   18  22 1
            24   22  23 1
            25   23  24 2
            26   24  25 1
            27   18  25 2
            28   20  26 2

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