KEGG   DRUG: CeftriaxoneHelp
Entry
D07659                      Drug                                   

Name
Ceftriaxone (INN);
CTRX;
Ceftriaxone (TN)
Formula
C18H18N8O7S3
Exact mass
554.0461
Mol weight
554.5799
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01714  Cephalosporin skeleton group
   DG01488  Cephem
 DG01776  Third-generation cephalosporin
 DG01804  Oxyimino beta-lactam
Remark
Same as: C06683
ATC code: J01DD04
Chemical structure group: DG00573
Product (DG00573): D00924<JP/US>
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
    J01DD Third-generation cephalosporins
     J01DD04 Ceftriaxone
      D07659  Ceftriaxone (INN)
USP drug classification [BR:br08302]
 Antibacterials
  Beta-lactam, Cephalosporins
   Ceftriaxone
    D07659  Ceftriaxone (INN)
BRITE hierarchy
Other DBs
CAS: 73384-59-5
PubChem: 51091963
ChEBI: 29007
ChEMBL: CHEMBL1398589 CHEMBL161
LigandBox: D07659
NIKKAJI: J11.973C
LinkDB All DBs
KCF data Show

ATOM        36
            1   C1y C    23.8000  -17.2900
            2   N1y N    23.8000  -18.6200
            3   C2y C    25.0600  -19.3200
            4   C2y C    26.2500  -18.6200
            5   C1x C    26.2500  -17.2900
            6   S2x S    25.0600  -16.5900
            7   C1y C    22.4000  -17.2900
            8   C5x C    22.4000  -18.6200
            9   N1b N    21.2100  -16.5900
            10  C5a C    20.0200  -17.2900
            11  O5a O    20.0200  -18.6200
            12  O5x O    21.2100  -19.3200
            13  C2c C    18.8300  -16.5900
            14  C1b C    27.4400  -19.3900
            15  C8y C    17.5700  -17.2900
            16  C8x C    16.4500  -16.4500
            17  S2x S    15.3300  -17.2900
            18  C8y C    15.7500  -18.6900
            19  N5x N    17.1500  -18.6900
            20  N2b N    18.8300  -15.1200
            21  C6a C    25.0600  -20.7200
            22  O6a O    26.2500  -21.4900
            23  O6a O    23.8000  -21.4200
            24  S2a S    28.6300  -18.6900
            25  C8y C    29.8200  -19.3900
            26  N1a N    14.9100  -19.8100
            27  N5x N    29.8200  -20.7900
            28  C8y C    31.0100  -21.4900
            29  C8y C    32.2700  -20.7900
            30  N4x N    32.2700  -19.3900
            31  N4y N    31.0100  -18.6900
            32  O5x O    31.0100  -22.8900
            33  O5x O    33.4600  -21.4900
            34  C1a C    31.0100  -17.2900
            35  O2a O    20.0200  -14.4200
            36  C1a C    20.0200  -13.0200
BOND        39
            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   13  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 1
            20   18  19 2
            21   15  19 1
            22   13  20 2
            23    3  21 1
            24   21  22 1
            25   21  23 2
            26   14  24 1
            27   24  25 1
            28   18  26 1
            29   25  27 2
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   25  31 1
            35   28  32 2
            36   29  33 2
            37   31  34 1
            38   20  35 1
            39   35  36 1

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