KEGG   COMPOUND: C22118
Entry
C22118                      Compound                               
Name
4alpha-Formylergosta-7,24(24(1))-dien-3beta-ol
Formula
C29H46O2
Exact mass
426.3498
Mol weight
426.67
Structure
Reaction
Enzyme
Other DBs
PubChem: 405226310
LinkDB
KCF data

ATOM        31
            1   C1x C    12.6615  -17.1385
            2   C1y C    12.6615  -18.5376
            3   C1y C    13.8507  -19.2371
            4   C1x C    13.8507  -16.4390
            5   C1z C    15.0399  -17.1385
            6   C1y C    15.0399  -18.5376
            7   C1x C    16.1592  -19.2371
            8   C2x C    17.4183  -18.5376
            9   C1y C    16.2291  -16.5089
            10  C2y C    17.4183  -17.1385
            11  C1x C    17.4183  -14.4103
            12  C1x C    16.2291  -15.1099
            13  C1z C    18.5376  -15.1099
            14  C1y C    18.5376  -16.5089
            15  C1x C    20.9160  -16.5089
            16  C1x C    20.9160  -15.1798
            17  C1y C    19.7967  -14.4803
            18  C1c C    19.7967  -13.0812
            19  C1b C    20.9859  -12.3817
            20  C1b C    22.1751  -13.0812
            21  C2c C    23.4343  -12.3817
            22  C1c C    24.5535  -13.0812
            23  C1a C    25.7427  -12.3817
            24  C1a C    24.5535  -14.4803
            25  C2a C    23.4343  -11.0526
            26  O1a O    11.4723  -19.2371
            27  C1a C    15.0399  -15.8094
            28  C1a C    18.4676  -13.7808
            29  C1a C    18.6075  -12.3817
            30  C4a C    13.8507  -20.5662
            31  O4a O    15.1099  -21.2657
BOND        34
            1     5   6 1
            2     6   7 1
            3     7   8 1
            4    13  14 1
            5    15  16 1
            6    16  17 1
            7    17  13 1
            8    14  15 1
            9     8  10 2
            10   17  18 1
            11    9   5 1
            12   18  19 1
            13    5   4 1
            14   19  20 1
            15    4   1 1
            16   20  21 1
            17   21  22 1
            18    1   2 1
            19   22  23 1
            20    9  10 1
            21   22  24 1
            22   10  14 1
            23   21  25 2
            24   13  11 1
            25    2  26 1 #Up
            26   11  12 1
            27    5  27 1 #Up
            28   12   9 1
            29   13  28 1 #Up
            30    2   3 1
            31   18  29 1 #Down
            32    3   6 1
            33    3  30 1 #Down
            34   30  31 2

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