KEGG   COMPOUND: C05440Help
Entry
C05440                      Compound                               

Name
Ergosta-5,7,22,24(28)-tetraen-3beta-ol;
Ergosta-5,7,22,24(24(1))-tetraen-3beta-ol;
5,7,22,24(28)-Ergostatetraenol
Formula
C28H42O
Exact mass
394.3236
Mol weight
394.6325
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid biosynthesis
Metabolic pathways
Biosynthesis of antibiotics
Module
M00102  
Ergocalciferol biosynthesis
Enzyme
1.3.1.71        1.14.19.41
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST01 Sterols
   ST0103 Ergosterols and C24-methyl derivatives
    C05440  Ergosta-5,7,22,24(28)-tetraen-3beta-ol
  ST03 Secosteroids
   ST0301 Vitamin D2 and derivatives
    C05440  Ergosta-5,7,22,24(28)-tetraen-3beta-ol
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        29
            1   C1c C    27.5888  -18.3243
            2   C2b C    28.7885  -17.6379
            3   C2b C    30.0008  -18.3378
            4   C2c C    31.2130  -17.6379
            5   C1c C    32.4252  -18.3378
            6   C1a C    33.6375  -17.6379
            7   C2a C    31.2130  -16.2381
            8   C1a C    32.4252  -19.7375
            9   C1a C    26.3736  -17.6217
            10  C1y C    26.4004  -21.8394
            11  C2y C    25.1750  -22.5283
            12  C1z C    26.4004  -20.4388
            13  C1y C    23.9685  -21.8203
            14  C2x C    25.1750  -23.9288
            15  C1x C    25.1940  -19.7309
            16  C1a C    26.3967  -19.0344
            17  C1z C    22.7545  -22.5169
            18  C1x C    23.9099  -20.4236
            19  C2x C    23.9571  -24.6252
            20  C2y C    22.7468  -23.9174
            21  C1x C    21.5403  -21.8166
            22  C1a C    22.7468  -21.1163
            23  C1x C    21.5403  -24.6214
            24  C1x C    20.3300  -22.5169
            25  C1y C    20.3300  -23.9174
            26  O1a O    19.1121  -24.6176
            27  C1x C    28.8253  -21.8394
            28  C1x C    28.8253  -20.4388
            29  C1y C    27.6128  -19.7388
BOND        32
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     4   7 2
            7     5   8 1
            8     1   9 1 #Down
            9    10  11 1
            10   10  12 1
            11   11  13 1
            12   11  14 2
            13   12  15 1
            14   12  16 1 #Up
            15   13  17 1
            16   13  18 1
            17   14  19 1
            18   17  20 1
            19   17  21 1
            20   17  22 1 #Up
            21   20  23 1
            22   21  24 1
            23   23  25 1
            24   25  26 1 #Up
            25   15  18 1
            26   19  20 2
            27   24  25 1
            28   10  27 1
            29   27  28 1
            30   28  29 1
            31   12  29 1
            32    1  29 1

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