KEGG   DRUG: Cephalothin sodiumHelp
Entry
D00907                      Drug                                   

Name
Cephalothin sodium (USP);
Cefalotin sodium (JP17);
CET;
Keflin (TN)
Formula
C16H15N2O6S2. Na
Exact mass
418.0269
Mol weight
418.4199
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01714  Cephalosporin skeleton group
   DG01488  Cephem
 DG01774  First-generation cephalosporin
Remark
Same as: C08100
Therapeutic category: 6132
ATC code: J01DB03
Chemical structure group: DG00549
Product (DG00549): D00907<JP>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Drug interaction
Structure map
map07012  Cephalosporins - parenteral agents
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
      D00907  Cephalothin sodium (USP) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  61  Antibiotics
   613  Acting mainly on gram-positive and gram-negative bacteria
    6132  Cephem antibioitics
     D00907  Cephalothin sodium (USP); Cefalotin sodium (JP17)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00907  Cefalotin sodium
  D00907  Cephalothin sodium for injection
Antiinfectives [br08350.html]
 Antibacterials
  D00907
BRITE hierarchy
Other DBs
CAS: 58-71-9
PubChem: 7847970
ChEBI: 3542
ChEMBL: CHEMBL1632
DrugBank: DB00456
LigandBox: D00907
NIKKAJI: J66.407C
KCF data Show

ATOM        27
            1   C1y C    27.7362  -14.5901
            2   N1y N    27.7362  -15.9871
            3   C2y C    28.9461  -16.6856
            4   C2y C    30.1561  -15.9871
            5   C1x C    30.1561  -14.5901
            6   S2x S    28.9461  -13.8916
            7   C1y C    26.3391  -14.5901
            8   C5x C    26.3391  -15.9871
            9   N1b N    25.1293  -13.8916
            10  C5a C    23.9193  -14.5901
            11  O5a O    23.9193  -15.9871
            12  O5x O    25.1293  -16.6856
            13  C1b C    22.7094  -13.8916
            14  C1b C    31.3846  -16.6967
            15  C6a C    28.9461  -18.0826
            16  O6a O    27.7195  -18.7910
            17  O6a O    30.1391  -18.7715 #-
            18  C8y C    21.4800  -14.6018
            19  O7a O    32.5994  -15.9955
            20  C7a C    33.8101  -16.6945
            21  C1a C    35.0208  -15.9955
            22  S2x S    20.3325  -13.8048
            23  C8x C    19.2182  -14.6499
            24  C8x C    19.6775  -15.9709
            25  C8x C    21.0757  -15.9422
            26  O6a O    33.8105  -18.1174
            27  Z   Na   31.5483  -18.8171 #+
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

» Japanese version   » Back

KEGG   DRUG: CefalotinHelp
Entry
D07635                      Drug                                   

Name
Cefalotin (BAN);
Cephalothin;
CET;
Cefalotina fabra (TN)
Formula
C16H16N2O6S2
Exact mass
396.045
Mol weight
396.438
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01714  Cephalosporin skeleton group
   DG01488  Cephem
 DG01774  First-generation cephalosporin
Remark
Same as: C07761
ATC code: J01DB03
Chemical structure group: DG00549
Product (DG00549): D00907<JP>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Drug interaction
Structure map
map07012  Cephalosporins - parenteral agents
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)
BRITE hierarchy
Other DBs
CAS: 153-61-7
PubChem: 51091939
ChEBI: 124991
ChEMBL: CHEMBL617
DrugBank: DB00456
PDB-CCD: CLS[PDBj]
LigandBox: D07635
NIKKAJI: J3.273E
KCF data Show

ATOM        26
            1   C1y C    24.7800  -16.5200
            2   N1y N    24.7800  -17.9200
            3   C2y C    26.0400  -18.6200
            4   C2y C    27.2300  -17.9200
            5   C1x C    27.2300  -16.5200
            6   S2x S    26.0400  -15.8200
            7   C1y C    23.3800  -16.5200
            8   C5x C    23.3800  -17.9200
            9   N1b N    22.1900  -15.8200
            10  C5a C    21.0000  -16.5200
            11  O5a O    21.0000  -17.9200
            12  O5x O    22.1900  -18.6200
            13  C1b C    19.7400  -15.8200
            14  C1b C    28.4200  -18.6900
            15  C6a C    26.0400  -20.0200
            16  O6a O    24.7800  -20.7200
            17  O6a O    27.2300  -20.7200
            18  C8y C    18.5500  -16.5900
            19  O7a O    29.6800  -17.9900
            20  C7a C    30.8700  -18.6200
            21  C1a C    32.0600  -17.9900
            22  S2x S    17.3600  -15.7500
            23  C8x C    16.3100  -16.5900
            24  C8x C    16.7300  -17.9200
            25  C8x C    18.1300  -17.9200
            26  O6a O    30.8700  -20.0900
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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