KEGG   COMPOUND: C06884Help
Entry
C06884                      Compound                               

Name
Ceforanide
Formula
C20H21N7O6S2
Exact mass
519.0995
Mol weight
519.554
Structure
Mol fileKCF fileDB search
Remark
Same as: D00259
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01D OTHER BETA-LACTAM ANTIBACTERIALS
    J01DC Second-generation cephalosporins
     J01DC11 Ceforanide
      D00259  Ceforanide (USP/INN)
BRITE hierarchy
Other DBs
CAS: 60925-61-3
PubChem: 9101
ChEBI: 3495
ChEMBL: CHEMBL1201046
NIKKAJI: J39.141G
LinkDB All DBs
KCF data Show

ATOM        35
            1   C1y C    26.7060  -15.2843
            2   N1y N    26.7060  -16.6717
            3   C2y C    27.9075  -17.3652
            4   C2y C    29.1091  -16.6717
            5   C1x C    29.1091  -15.2843
            6   S2x S    27.9075  -14.5906
            7   C1y C    25.3186  -15.2843
            8   C5x C    25.3186  -16.6717
            9   N1b N    24.1172  -14.5906
            10  C5a C    22.9157  -15.2843
            11  O5a O    22.9157  -16.6717
            12  O5x O    24.1172  -17.3652
            13  C1b C    21.7143  -14.5906
            14  C1b C    30.3289  -17.3763
            15  C6a C    27.9075  -18.7525
            16  O6a O    26.6893  -19.4560
            17  O6a O    29.0922  -19.4364
            18  C8y C    20.4933  -15.2959
            19  S2a S    31.5352  -16.6800
            20  C8y C    32.7364  -17.3738
            21  N5x N    33.2077  -18.6776
            22  N5x N    34.5953  -18.7061
            23  N5x N    34.9842  -17.3027
            24  N4y N    33.8368  -16.5212
            25  C1b C    33.8368  -15.1083
            26  C6a C    35.0798  -14.3908
            27  O6a O    36.2838  -15.0862
            28  O6a O    35.0801  -12.9675
            29  C8y C    19.2447  -14.5750
            30  C8x C    18.0177  -15.2834
            31  C8x C    18.0176  -16.7003
            32  C8x C    19.2662  -17.4213
            33  C8x C    20.4932  -16.7128
            34  C1b C    19.2449  -13.1797
            35  N1a N    18.0254  -12.4753
BOND        38
            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 2
            23   21  22 1
            24   22  23 2
            25   23  24 1
            26   20  24 1
            27   24  25 1
            28   25  26 1
            29   26  27 1
            30   26  28 2
            31   18  29 2
            32   29  30 1
            33   30  31 2
            34   31  32 1
            35   32  33 2
            36   18  33 1
            37   29  34 1
            38   34  35 1

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