KEGG   COMPOUND: C08122Help
Entry
C08122                      Compound                               

Name
Bacampicillin
Formula
C21H27N3O7S
Exact mass
465.157
Mol weight
465.52
Structure
Mol fileKCF fileDB search
Remark
Same as: D07487
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
    J01CA Penicillins with extended spectrum
     J01CA06 Bacampicillin
      D07487  Bacampicillin (INN)
Prodrugs [br08324.html]
 D07487
BRITE hierarchy
Other DBs
CAS: 50972-17-3
PubChem: 10322
ChEBI: 2968
ChEMBL: CHEMBL1583
NIKKAJI: J14.626I
LinkDB All DBs
KCF data Show

ATOM        32
            1   C1y C    25.2468  -14.2385
            2   C5x C    25.2468  -15.6431
            3   N1y N    26.6514  -15.6431
            4   C1y C    26.6514  -14.2385
            5   C1y C    27.9857  -16.0644
            6   C1z C    28.8283  -14.9407
            7   S2x S    27.9857  -13.8171
            8   C1a C    29.8117  -15.9240
            9   C1a C    29.8117  -13.9575
            10  C7a C    28.4773  -17.3987
            11  O7a O    29.8818  -17.3987
            12  O6a O    27.6344  -18.5223
            13  N1b N    24.0529  -13.5362
            14  C5a C    22.8590  -14.2385
            15  O5x O    24.0529  -16.3453
            16  O5a O    22.8590  -15.6431
            17  C1c C    21.6398  -13.5411
            18  C8y C    20.4476  -14.2362
            19  N1a N    21.6398  -12.1401
            20  C8x C    19.2342  -13.5357
            21  C8x C    18.0209  -14.2362
            22  C8x C    18.0209  -15.6372
            23  C8x C    19.2342  -16.3377
            24  C8x C    20.4476  -15.6372
            25  C1c C    30.5996  -18.6417
            26  O7a O    31.9928  -18.6414
            27  C1a C    29.9059  -19.8435
            28  C7a C    32.7005  -17.4150
            29  O7a O    34.0931  -17.4149
            30  O6a O    32.0061  -16.2129
            31  C1b C    34.7852  -16.2158
            32  C1a C    36.1932  -16.2156
BOND        34
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     3   5 1
            6     5   6 1
            7     6   7 1
            8     4   7 1
            9     6   8 1
            10    6   9 1
            11    5  10 1 #Down
            12   10  11 1
            13   10  12 2
            14    1  13 1 #Up
            15   13  14 1
            16    2  15 2
            17   14  16 2
            18   14  17 1
            19   17  18 1
            20   17  19 1 #Up
            21   18  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   18  24 1
            27   11  25 1
            28   25  26 1
            29   25  27 1
            30   26  28 1
            31   28  29 1
            32   28  30 2
            33   29  31 1
            34   31  32 1

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