KEGG   COMPOUND: C15816
Entry
C15816                      Compound                               

Name
3-Keto-4-methylzymosterol
Formula
C28H44O
Exact mass
396.3392
Mol weight
396.6484
Structure
Reaction
Pathway
map00100  Steroid biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00101  Cholesterol biosynthesis, squalene 2,3-epoxide => cholesterol
M00102  Ergocalciferol biosynthesis, squalene 2,3-epoxide => ergosterol/ergocalciferol
Enzyme
1.1.1.170       1.1.1.270
Other DBs
PubChem: 47205141
ChEBI: 50593
LIPIDMAPS: LMST01010167
NIKKAJI: J1.817.124D
LinkDB
KCF data

ATOM        29
            1   C2y C    20.9730  -16.8458
            2   C2y C    19.7739  -16.1525
            3   C1y C    22.1783  -16.1400
            4   C1x C    20.9855  -18.2322
            5   C1z C    18.5811  -16.8520
            6   C1x C    19.7614  -14.7662
            7   C1z C    22.1847  -14.7537
            8   C1x C    24.5891  -16.1525
            9   C1x C    19.7803  -18.9192
            10  C1y C    18.5811  -18.2259
            11  C1x C    17.3944  -16.1714
            12  C1a C    18.5749  -15.5531
            13  C1x C    20.9669  -14.0604
            14  C1y C    23.3899  -14.0542
            15  C1a C    22.1783  -13.3923
            16  C1x C    24.5891  -14.7598
            17  C1y C    17.3944  -18.9192
            18  C1x C    16.2142  -16.8520
            19  C1c C    23.3961  -12.6990
            20  C5x C    16.2142  -18.2259
            21  C1b C    24.5703  -12.0245
            22  C1a C    22.2222  -12.0120
            23  O5x O    15.0339  -18.9005
            24  C1b C    25.7444  -12.7053
            25  C2b C    26.9247  -12.0307
            26  C2c C    28.0988  -12.7115
            27  C1a C    29.2791  -12.0370
            28  C1a C    28.0925  -14.0729
            29  C1a C    17.3934  -20.2938
BOND        32
            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 2
            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

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