KEGG   COMPOUND: C06683Help
Entry
C06683                      Compound                               

Name
Ceftriaxone
Formula
C18H18N8O7S3
Exact mass
554.0461
Mol weight
554.5799
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Compounds with biological roles [BR:br08001]
 Antibiotics
  beta-Lactams
   Cephems
    C06683  Ceftriaxone
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)
Antiinfectives [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor
   Penicillin binding proteins inhibitor
    Cephems - Cephalosporins
     Ceftriaxone
      D07659  Ceftriaxone (INN)
BRITE hierarchy
Other DBs
CAS: 
73384-59-5
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        36
            1   C1y C    24.7786  -18.1994
            2   N1y N    24.7786  -19.5293
            3   C2y C    26.0383  -20.2292
            4   C2y C    27.2282  -19.5293
            5   C1x C    27.2282  -18.1994
            6   S2x S    26.0383  -17.4994
            7   C1y C    23.3787  -18.1994
            8   C5x C    23.3787  -19.5293
            9   N1b N    22.1888  -17.4994
            10  C5a C    20.9989  -18.1994
            11  O5a O    20.9989  -19.5293
            12  O5x O    22.1888  -20.2292
            13  C2c C    19.8090  -17.4994
            14  C1b C    28.4181  -20.2992
            15  C8y C    18.5491  -18.1994
            16  C8x C    17.4292  -17.3595
            17  S2x S    16.3093  -18.1994
            18  C8y C    16.7293  -19.5992
            19  N5x N    18.1292  -19.5992
            20  N2b N    19.8090  -16.0297
            21  C6a C    26.0383  -21.6291
            22  O6a O    27.2282  -22.3990
            23  O6a O    24.7786  -22.3290
            24  S2a S    29.6080  -19.5992
            25  C8y C    30.7979  -20.2992
            26  N1a N    15.8894  -20.7191
            27  N5x N    30.7979  -21.6991
            28  C8y C    31.9878  -22.3990
            29  C8y C    33.2477  -21.6991
            30  N4x N    33.2477  -20.2992
            31  N4y N    31.9878  -19.5992
            32  O5x O    31.9878  -23.7989
            33  O5x O    34.4376  -22.3990
            34  C1a C    31.9878  -18.1994
            35  O2a O    21.0162  -15.3193
            36  C1a C    21.0162  -13.9193
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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