KEGG   COMPOUND: C22115
Entry
C22115                      Compound                               
Name
4alpha-Formyl-4beta,14alpha-dimethyl-9beta,19-cyclo-5alpha-ergost-24(24(1))-en-3beta-ol
Formula
C31H50O2
Exact mass
454.3811
Mol weight
454.7275
Structure
Reaction
Enzyme
Other DBs
PubChem: 405226307
LinkDB
KCF data

ATOM        33
            1   C1z C    16.2468  -16.2468
            2   C1z C    15.0562  -16.9471
            3   C1y C    17.3673  -16.9471
            4   C1x C    14.9862  -15.5465
            5   C1x C    16.2468  -14.8462
            6   C1y C    15.0562  -18.3477
            7   C1x C    13.8658  -16.2468
            8   C1z C    18.6278  -16.2468
            9   C1x C    17.3673  -18.3477
            10  C1x C    17.4373  -14.2159
            11  C1z C    13.8658  -19.0480
            12  C1x C    16.1768  -19.0480
            13  C1x C    12.6753  -16.9471
            14  C1z C    18.6979  -14.9162
            15  C1x C    21.0088  -16.2468
            16  C1a C    18.6278  -17.6474
            17  C1y C    12.6753  -18.3477
            18  C1y C    19.8883  -14.2159
            19  C1a C    18.6979  -13.5156
            20  C1x C    21.0088  -14.9162
            21  O1a O    11.4848  -19.0480
            22  C1c C    19.8883  -12.8153
            23  C1b C    21.0088  -12.1851
            24  C1a C    18.6979  -12.1851
            25  C1b C    22.1993  -12.8153
            26  C2c C    23.3898  -12.1851
            27  C1c C    24.5803  -12.8153
            28  C2a C    23.3898  -10.7845
            29  C1a C    24.5803  -14.2159
            30  C1a C    25.7708  -12.1150
            31  C1a C    13.1655  -20.2385
            32  C4a C    14.1458  -20.5180
            33  O4a O    15.2183  -21.0080
BOND        37
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     5  10 1
            10    6  11 1
            11    6  12 1
            12    7  13 1
            13    8  14 1
            14    8  15 1
            15    8  16 1 #Down
            16   11  17 1
            17   14  18 1
            18   14  19 1 #Up
            19   15  20 1
            20   17  21 1 #Up
            21   18  22 1
            22   22  23 1
            23   22  24 1 #Down
            24   23  25 1
            25   25  26 1
            26   26  27 1
            27   26  28 2
            28   27  29 1
            29   27  30 1
            30    2   4 1 #Up
            31    9  12 1
            32   10  14 1
            33   13  17 1
            34   18  20 1
            35   11  31 1 #Up
            36   11  32 1 #Down
            37   32  33 2

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