KEGG   COMPOUND: C05993Help
Entry
C05993                      Compound                               

Name
Acetyl adenylate;
5'-Acetylphosphoadenosine
Formula
C12H16N5O8P
Exact mass
389.0736
Mol weight
389.2579
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Purine metabolism
Pyruvate metabolism
Enzyme
3.6.1.20        6.2.1.1
Other DBs
CAS: 
13015-87-7
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   N4y N    29.5402  -19.9266
            2   C8y C    30.6113  -20.6660
            3   C1y C    28.2596  -20.3458
            4   C8x C    30.0233  -18.5296
            5   C8y C    31.8452  -19.7578
            6   N5x N    30.7451  -22.0861
            7   O2x O    27.1187  -19.4900
            8   C1y C    27.8288  -21.5972
            9   N5x N    31.4727  -18.5354
            10  C8y C    33.1027  -20.3108
            11  C8x C    32.0724  -22.6741
            12  C1y C    26.0128  -20.2875
            13  C1y C    26.4434  -21.5972
            14  O1a O    28.4866  -22.8721
            15  N5x N    33.2656  -21.8010
            16  N1a N    34.2086  -19.4844
            17  C1b C    24.6914  -19.8569
            18  O1a O    25.9254  -22.8487
            19  O2b O    23.6552  -20.7822
            20  P1b P    22.2581  -20.7822
            21  O7a O    20.8671  -20.7822
            22  O1c O    22.2525  -22.1793
            23  O1c O    22.2525  -19.3912
            24  C7a C    19.6476  -20.0900
            25  C1a C    18.4351  -20.7900
            26  O6a O    19.6425  -18.6903
BOND        28
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 1
            22   20  23 2
            23    5   9 1
            24   11  15 1
            25   12  13 1
            26   21  24 1
            27   24  25 1
            28   24  26 2

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