KEGG   COMPOUND: C12371Help
Entry
C12371                      Compound                               

Name
Tetracenomycin A2
Formula
C23H18O8
Exact mass
422.1002
Mol weight
422.3842
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Biosynthesis of type II polyketide products
Biosynthesis of antibiotics
Module
M00783  
Tetracenomycin C/8-demethyltetracenomycin C biosynthesis, tetracenomycin F2 => tetracenomycin C/8-demethyltetracenomycin C
Enzyme
1.14.13.200     2.1.1.-
Other DBs
CAS: 
82277-62-1
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        31
            1   C8x C    25.7549  -15.8677
            2   C8y C    19.8309  -16.5372
            3   C8x C    21.0144  -15.8650
            4   C8y C    22.1982  -16.5372
            5   C5x C    23.3913  -15.8745
            6   C8y C    24.5748  -16.5467
            7   C8x C    19.8268  -18.0391
            8   C8y C    26.9421  -16.5563
            9   C8x C    28.1352  -15.8745
            10  C8y C    29.3092  -16.5563
            11  C8y C    21.0051  -18.7304
            12  C8y C    22.1886  -18.0486
            13  C5x C    23.3817  -18.7397
            14  C8y C    24.5653  -18.0579
            15  C8y C    25.7490  -18.7492
            16  C8y C    26.9325  -18.0675
            17  C8y C    28.1256  -18.7588
            18  C8y C    29.3092  -18.0675
            19  O1a O    20.9956  -20.1032
            20  O5x O    23.3722  -20.1128
            21  O1a O    25.7490  -20.1223
            22  C1a C    28.1161  -20.1223
            23  O2a O    18.6378  -15.8650
            24  C7a C    30.4972  -18.7515
            25  O7a O    31.6917  -18.0627
            26  O6a O    30.5000  -20.1246
            27  O5x O    23.3817  -14.5014
            28  O2a O    30.4929  -15.8838
            29  C1a C    17.4456  -16.5483
            30  C1a C    32.8857  -18.7529
            31  C1a C    31.7232  -16.6058
BOND        34
            1    15  16 2
            2     4   5 1
            3    16  17 1
            4     8   9 1
            5    17  18 2
            6    11  19 1
            7     9  10 2
            8    13  20 2
            9     5   6 1
            10   15  21 1
            11    7  11 1
            12   17  22 1
            13    6   1 1
            14    2  23 1
            15    4  12 1
            16    6  14 2
            17    8  16 1
            18   10  18 1
            19   11  12 2
            20   18  24 1
            21    3   4 2
            22   24  25 1
            23   12  13 1
            24   24  26 2
            25    2   7 2
            26    5  27 2
            27   13  14 1
            28   10  28 1
            29    2   3 1
            30   23  29 1
            31   14  15 1
            32   25  30 1
            33    1   8 2
            34   28  31 1

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