KEGG   COMPOUND: C04425Help
Entry
C04425                      Compound                               

Name
S-Adenosyl-4-methylthio-2-oxobutanoate;
S-Adenosyl-4-(methylsulfanyl)-2-oxobutanoate
Formula
C15H20N5O6S
Exact mass
398.1134
Mol weight
398.4142
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
Other DBs
PubChem: 7057
ChEBI: 8944
NIKKAJI: J2.751.123F
LinkDB All DBs
KCF data Show

ATOM        27
            1   N4y N    33.9449  -15.9608
            2   C8y C    32.6340  -15.5355
            3   C1y C    32.8379  -18.0290
            4   C8x C    34.7431  -14.8597
            5   C8y C    32.6340  -14.1663
            6   N5x N    31.4396  -16.2347
            7   O2x O    31.7309  -17.2425
            8   C1y C    32.4184  -19.3400
            9   N5x N    33.9449  -13.7351
            10  C8y C    31.4396  -13.4788
            11  C8x C    30.2569  -15.5355
            12  C1y C    30.6355  -18.0290
            13  C1y C    31.0434  -19.3400
            14  O1a O    33.3098  -20.3362
            15  N5x N    30.2569  -14.1663
            16  N1a N    31.4339  -12.1154
            17  C1b C    29.3364  -17.6038
            18  O1a O    30.2395  -20.4411
            19  S0  S    28.3284  -16.7123 #+
            20  C1b C    27.1457  -17.3941
            21  C1a C    28.3284  -15.3549
            22  C1b C    25.9629  -16.7123
            23  C5a C    24.7802  -17.3941
            24  C6a C    23.5975  -16.7123
            25  O5a O    24.7802  -18.7632
            26  O6a O    22.4207  -17.3998
            27  O6a O    23.6034  -15.3549
BOND        29
            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   19  21 1
            21   20  22 1
            22   22  23 1
            23   23  24 1
            24   23  25 2
            25   24  26 1
            26   24  27 2
            27    5   9 1
            28   11  15 1
            29   12  13 1

» Japanese version

DBGET integrated database retrieval system