KEGG   COMPOUND: C22112Help
Entry
C22112                      Compound                               

Name
4alpha-Carboxy-5alpha-cholesta-8,24-dien-3beta-ol
Formula
C28H44O3
Exact mass
428.329
Mol weight
428.6472
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00100  Steroid biosynthesis
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00101  Cholesterol biosynthesis, squalene 2,3-epoxide => cholesterol
Enzyme
1.1.1.170       1.14.18.9
KCF data Show

ATOM        31
            1   C2y C    17.4696  -16.4130
            2   C2y C    16.2721  -15.7791
            3   C1y C    18.6671  -15.7791
            4   C1x C    17.4696  -17.7514
            5   C1z C    15.0747  -16.4130
            6   C1x C    16.2721  -14.3703
            7   C1z C    18.6671  -14.3703
            8   C1x C    21.0621  -15.7791
            9   C1x C    16.3426  -18.4558
            10  C1y C    15.0747  -17.7514
            11  C1x C    13.8772  -15.7791
            12  C1a C    15.0747  -15.1451
            13  C1x C    17.4696  -13.6659
            14  C1y C    19.8646  -13.6659
            15  C1a C    18.6671  -12.9615
            16  C1x C    21.0621  -14.3703
            17  C1y C    13.8772  -18.4558
            18  C1x C    12.7501  -16.4130
            19  C1c C    19.8646  -12.2571
            20  C1y C    12.7501  -17.7514
            21  C1b C    21.0621  -11.6231
            22  C1a C    18.6671  -11.6231
            23  O1a O    11.5526  -18.4558
            24  C1b C    22.2596  -12.3275
            25  C2b C    23.4571  -11.6231
            26  C2c C    24.5841  -12.3275
            27  C1a C    25.7816  -11.6231
            28  C1a C    24.5841  -13.6659
            29  C6a C    13.8772  -19.8646
            30  O6a O    15.0747  -20.5690
            31  O6a O    12.6797  -20.7803
BOND        34
            1     1   2 2
            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     5  10 1
            10    5  11 1
            11    5  12 1 #Up
            12    6  13 1
            13    7  14 1
            14    7  15 1 #Up
            15    8  16 1
            16   10  17 1
            17   11  18 1
            18   14  19 1
            19   17  20 1
            20   19  21 1
            21   19  22 1 #Down
            22   20  23 1 #Up
            23   21  24 1
            24   24  25 1
            25   25  26 2
            26   26  27 1
            27   26  28 1
            28    7  13 1
            29    9  10 1
            30   14  16 1
            31   18  20 1
            32   17  29 1 #Down
            33   29  30 2
            34   29  31 1

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