KEGG   COMPOUND: C01558Help
Entry
C01558                      Compound                               

Name
Bile salt;
Bile acid
Formula
C24H40O5
Exact mass
408.2876
Mol weight
408.5714
Structure
Mol fileKCF fileDB searchJmolKegDraw
Pathway
Fat digestion and absorption
Vitamin digestion and absorption
Vibrio cholerae pathogenic cycle
Other DBs
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        29
            1   C1y C    25.9854  -23.0500
            2   C1y C    27.1787  -22.3512
            3   C1y C    24.7980  -22.3699
            4   C1y C    25.9979  -24.4228
            5   C1z C    27.1850  -20.9785
            6   C1x C    29.5660  -22.3636
            7   C1z C    23.6231  -23.0562
            8   C1x C    24.7858  -20.9910
            9   C1x C    24.8106  -25.1029
            10  O1a O    27.1601  -25.0968
            11  C1y C    28.3785  -20.2860
            12  C1y C    25.9792  -20.2920
            13  C1a C    27.1766  -19.6997
            14  C1x C    29.5409  -20.9600
            15  C1y C    23.6231  -24.4167
            16  C1x C    22.4422  -22.3884
            17  C1a C    23.6046  -21.7144
            18  C1c C    28.3845  -18.7356
            19  O1a O    26.1195  -19.2289
            20  C1x C    22.4422  -25.1029
            21  C1x C    21.2735  -23.0562
            22  C1b C    29.5532  -18.0677
            23  C1a C    27.2914  -17.4968
            24  C1y C    21.2735  -24.4167
            25  C1b C    30.7157  -18.7417
            26  O1a O    20.1109  -25.0844
            27  C6a C    31.8783  -18.0740
            28  O6a O    33.0407  -18.7543
            29  O6a O    31.8843  -16.7954
BOND        32
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     4  10 1 #Down
            10    5  11 1
            11    5  12 1
            12    5  13 1
            13    6  14 1
            14    7  15 1
            15    7  16 1
            16    7  17 1
            17   11  18 1
            18   12  19 1 #Down
            19   15  20 1
            20   16  21 1
            21   18  22 1
            22   18  23 1
            23   20  24 1
            24   22  25 1
            25   24  26 1 #Down
            26   25  27 1
            27   27  28 1
            28   27  29 2
            29    8  12 1
            30    9  15 1
            31   11  14 1
            32   21  24 1

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