KEGG   COMPOUND: C15778
Entry
C15778                      Compound                               

Name
5,7,24(28)-Ergostatrienol;
Ergosta-5,7,24(28)-trien-3beta-ol
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
M00102  Ergocalciferol biosynthesis, squalene 2,3-epoxide => ergosterol/ergocalciferol
Enzyme
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C15778  5,7,24(28)-Ergostatrienol
Other DBs
PubChem: 47205104
ChEBI: 80095
NIKKAJI: J527.837F
LinkDB
KCF data

ATOM        29
            1   C1y C    26.4095  -21.9826
            2   C2y C    25.2116  -22.6778
            3   C1z C    26.4159  -20.5983
            4   C1x C    28.8120  -21.9578
            5   C1y C    24.0198  -21.9951
            6   C2x C    25.1936  -24.1677
            7   C1y C    27.6139  -19.9031
            8   C1x C    25.2054  -19.9155
            9   C1a C    26.3707  -19.1767
            10  C1x C    28.8120  -20.6046
            11  C1z C    22.8403  -22.6903
            12  C1x C    24.0074  -20.6108
            13  C2x C    24.0321  -24.7388
            14  C1c C    27.5501  -18.5560
            15  C2y C    22.8403  -24.0497
            16  C1x C    21.6546  -22.0136
            17  C1a C    22.7872  -21.3077
            18  C1b C    28.7935  -17.8856
            19  C1a C    26.4532  -17.8794
            20  C1x C    21.6546  -24.7451
            21  C1x C    20.4876  -22.6903
            22  C1b C    29.9604  -18.5623
            23  C1y C    20.4876  -24.0497
            24  O1a O    19.3144  -24.7203
            25  C2c C    31.1779  -17.8739
            26  C1c C    32.3996  -18.5793
            27  C1a C    33.6215  -17.8739
            28  C1a C    32.3996  -19.9900
            29  C2a C    31.1842  -16.4634
BOND        32
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     3   9 1 #Up
            9     4  10 1
            10    5  11 1
            11    5  12 1
            12    6  13 1
            13    7  14 1
            14   11  15 1
            15   11  16 1
            16   11  17 1 #Up
            17   14  18 1
            18   14  19 1
            19   15  20 1
            20   16  21 1
            21   18  22 1
            22   20  23 1
            23   23  24 1 #Up
            24    7  10 1
            25    8  12 1
            26   13  15 2
            27   21  23 1
            28   22  25 1
            29   25  26 1
            30   26  27 1
            31   26  28 1
            32   25  29 2

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