KEGG   DRUG: CefacetrileHelp
Entry
D07629                      Drug                                   

Name
Cefacetrile (INN);
Cephacetrile;
Vetrimast [veterinary] (TN)
Formula
C13H13N3O6S
Exact mass
339.0525
Mol weight
339.3238
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01714  Cephalosporin skeleton group
   DG01488  Cephem
 DG01774  First-generation cephalosporin
Remark
ATC code: J01DB10
Chemical structure group: DG00554
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Drug interaction
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
     J01DB10 Cefacetrile
      D07629  Cefacetrile (INN)
BRITE hierarchy
Other DBs
CAS: 10206-21-0
PubChem: 51091937
ChEMBL: CHEMBL2110602
DrugBank: DB01414
LigandBox: D07629
NIKKAJI: J9.817E
LinkDB All DBs
KCF data Show

ATOM        23
            1   C1y C    24.2900  -16.5200
            2   N1y N    24.2900  -17.9200
            3   C2y C    25.4800  -18.6200
            4   C2y C    26.6700  -17.9200
            5   C1x C    26.6700  -16.5200
            6   S2x S    25.4800  -15.8200
            7   C1y C    22.8200  -16.5200
            8   C5x C    22.8200  -17.9200
            9   N1b N    21.6300  -15.8200
            10  C5a C    20.4400  -16.5200
            11  O5a O    20.4400  -17.9200
            12  O5x O    21.6300  -18.6200
            13  C1b C    19.1800  -15.8200
            14  C3b C    17.9900  -16.5200
            15  C1b C    27.9300  -18.6200
            16  O7a O    29.1200  -17.9200
            17  C7a C    30.3100  -18.6200
            18  C1a C    31.5000  -17.9200
            19  O6a O    30.3100  -20.0200
            20  C6a C    25.4800  -20.0200
            21  O6a O    24.2200  -20.7200
            22  O6a O    26.6700  -20.7200
            23  N3a N    16.8000  -17.2200
BOND        24
            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   13  14 1
            16    4  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   17  19 2
            21    3  20 1
            22   20  21 2
            23   20  22 1
            24   14  23 3

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