KEGG   COMPOUND: C22448
Entry
C22448                      Compound                               
Name
16alpha,22,26-Trihydroxycholesterol
Formula
C27H46O4
Exact mass
434.3396
Mol weight
434.65
Structure
Reaction
Pathway
map00996  Biosynthesis of various alkaloids
Enzyme
1.14.11.-
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0101 Cholesterol and derivatives
    C22448  16alpha,22,26-Trihydroxycholesterol
Other DBs
PubChem: 497619807
LinkDB
KCF data

ATOM        31
            1   C1y C    18.5369  -17.5576
            2   C1y C    17.4177  -18.2571
            3   C1z C    18.5369  -16.2285
            4   C1x C    20.9152  -17.5576
            5   C1y C    16.2285  -17.5576
            6   C1x C    17.4177  -19.5861
            7   C1y C    19.7260  -15.5290
            8   C1x C    17.4177  -15.5290
            9   C1a C    18.5369  -14.8995
            10  C1y C    20.9152  -16.2285
            11  C1z C    15.0394  -18.2571
            12  C1x C    16.2285  -16.2285
            13  C2x C    16.2285  -20.2857
            14  C1c C    19.7260  -14.2000
            15  C2y C    15.0394  -19.5861
            16  C1x C    13.8502  -17.5576
            17  C1a C    15.0394  -16.9280
            18  C1c C    20.9152  -13.5005
            19  C1a C    18.5369  -13.5005
            20  C1x C    13.8502  -20.2857
            21  C1x C    12.7310  -18.2571
            22  C1b C    22.1044  -14.2000
            23  C1y C    12.7310  -19.5861
            24  C1b C    23.2935  -13.5005
            25  O1a O    11.5418  -20.2857
            26  C1c C    24.4827  -14.2000
            27  C1a C    25.6718  -13.5005
            28  C1b C    24.4827  -15.8088
            29  O1a O    20.9152  -12.1014
            30  O1a O    25.6718  -16.5083
            31  O1a O    22.1365  -15.5299
BOND        34
            1     1   2 1
            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     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 #Down
            19   15  20 1
            20   16  21 1
            21   18  22 1
            22   20  23 1
            23   22  24 1
            24   23  25 1 #Up
            25   24  26 1
            26   26  27 1
            27   26  28 1
            28    7  10 1
            29    8  12 1
            30   13  15 2
            31   21  23 1
            32   18  29 1
            33   28  30 1
            34   10  31 1 #Down

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