KEGG   COMPOUND: C05554Help
Entry
C05554                      Compound                               

Name
Aerobactin
Formula
C22H36N4O13
Exact mass
564.2279
Mol weight
564.5402
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Lysine degradation
Microbial metabolism in diverse environments
Enzyme
Other DBs
CAS: 
26198-65-2
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        39
            1   C1a C    10.1500  -23.9400
            2   C5a C    11.3624  -23.2400
            3   N1c N    12.5749  -23.9400
            4   C1b C    13.7873  -23.2400
            5   C1b C    14.9997  -23.9400
            6   C1b C    16.2122  -23.2400
            7   C1b C    17.4246  -23.9400
            8   C1c C    18.6370  -23.2400
            9   C6a C    19.8495  -23.9400
            10  O6a O    21.0619  -23.2400
            11  N1b N    18.6370  -21.8401
            12  O5a O    11.3624  -21.8402
            13  O1b O    12.5749  -25.3398
            14  O6a O    19.8495  -25.3397
            15  C5a C    19.8324  -21.1400
            16  C1b C    21.0449  -21.8400
            17  C1d C    22.2573  -21.1400
            18  C1b C    23.4697  -21.8400
            19  C5a C    24.9622  -21.1400
            20  N1b N    26.1746  -21.8400
            21  C1c C    27.3870  -21.1400
            22  C1b C    28.5995  -21.8400
            23  C1b C    29.8119  -21.1400
            24  C1b C    31.0244  -21.8400
            25  C1b C    32.2368  -21.1400
            26  N1c N    33.4492  -21.8400
            27  C5a C    34.6617  -21.1400
            28  C1a C    35.8741  -21.8400
            29  O5a O    19.8281  -19.7401
            30  C6a C    22.2573  -19.7400
            31  O6a O    23.4018  -19.1088
            32  O6a O    21.0469  -19.0412
            33  O1a O    23.4018  -20.5088
            34  O5a O    24.9622  -19.8800
            35  C6a C    27.3870  -19.7401
            36  O6a O    26.1618  -19.0326
            37  O6a O    28.5867  -19.0474
            38  O5a O    34.6617  -19.7400
            39  O1b O    33.4492  -23.2400
BOND        38
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10    8  11 1 #Down
            11    2  12 2
            12    3  13 1
            13    9  14 2
            14   11  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   15  29 2
            29   17  30 1
            30   30  31 1
            31   30  32 2
            32   17  33 1
            33   19  34 2
            34   21  35 1 #Down
            35   35  36 2
            36   35  37 1
            37   27  38 2
            38   26  39 1

» Japanese version

DBGET integrated database retrieval system