KEGG   COMPOUND: C08275Help
Entry
C08275                      Compound                               

Name
L-Djenkolic acid;
Djenkolic acid
Formula
C7H14N2O4S2
Exact mass
254.0395
Mol weight
254.3271
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
498-59-9
PubChem: 
ChEBI: 
KNApSAcK: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        15
            1   C1c C    24.3603  -19.9331
            2   C1b C    25.5755  -19.2378
            3   C6a C    23.1509  -19.2437
            4   N1a N    24.3545  -21.3410
            5   S2a S    26.7849  -19.9272
            6   O6a O    21.9358  -19.9446
            7   O6a O    23.1452  -17.8356
            8   C1b C    28.0000  -19.2320
            9   S2a S    29.2151  -19.9214
            10  C1b C    30.4304  -19.2203
            11  C1c C    31.6455  -19.9155
            12  C6a C    32.8491  -19.2144
            13  N1a N    31.6397  -21.3176
            14  O6a O    34.0642  -19.9097
            15  O6a O    32.8431  -17.8122
BOND        14
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     3   6 1
            6     3   7 2
            7     5   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   11  13 1 #Up
            13   12  14 1
            14   12  15 2

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