KEGG   COMPOUND: C06341
Entry
C06341                      Compound                               
Name
7alpha,27-Dihydroxycholesterol;
Cholest-5-ene-3beta,7alpha,26-triol;
Cholest-5-ene-3beta,7alpha,27-triol
Formula
C27H46O3
Exact mass
418.3447
Mol weight
418.6523
Structure
Reaction
Pathway
map00120  Primary bile acid biosynthesis
Enzyme
1.1.1.181       1.14.14.23      1.14.14.29
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST01 Sterols
   ST0101 Cholesterol and derivatives
    C06341  7-alpha,27-Dihydroxycholesterol
  ST04 Bile acids and derivatives
   ST0403 C27 bile acids, alcohols, and derivatives
    C06341  7alpha,27-Dihydroxycholesterol
Other DBs
CAS: 4725-24-0
PubChem: 8577
ChEBI: 18431
LIPIDMAPS: LMST04030081
3DMET: B05185
NIKKAJI: J575.886F
KCF data

ATOM        30
            1   C1y C    24.5342  -20.0719
            2   C1y C    23.3606  -20.7492
            3   C1z C    24.5342  -18.7173
            4   C1x C    26.8814  -20.0719
            5   C1y C    22.1928  -20.0719
            6   C1y C    23.3547  -22.1038
            7   C1y C    25.7196  -18.0400
            8   C1x C    23.3606  -18.0400
            9   C1a C    24.5283  -17.3627
            10  C1x C    26.8814  -18.7173
            11  C1z C    21.0076  -20.7492
            12  C1x C    22.1928  -18.7173
            13  C2x C    22.1928  -22.7810
            14  C1c C    25.7196  -16.6853
            15  C2y C    21.0076  -22.1038
            16  C1x C    19.8398  -20.0719
            17  C1a C    20.9959  -19.3946
            18  C1b C    26.9165  -15.9963
            19  C1a C    24.5166  -15.9905
            20  C1x C    19.8398  -22.7810
            21  C1x C    18.6664  -20.7492
            22  C1b C    28.1136  -16.6911
            23  C1y C    18.6664  -22.1038
            24  C1b C    29.3104  -15.9963
            25  O1a O    17.4811  -22.7810
            26  C1c C    30.5131  -16.6911
            27  C1b C    31.7101  -16.0020
            28  C1a C    30.5073  -18.0751
            29  O1a O    32.9216  -16.7036
            30  O1a O    24.5829  -22.8130
BOND        33
            1     1   4 1
            2     2   5 1
            3     2   6 1
            4     3   7 1
            5     3   8 1
            6     3   9 1 #Up
            7     4  10 1
            8     5  11 1
            9     5  12 1
            10    6  13 1
            11    7  14 1
            12   11  15 1
            13   11  16 1
            14   11  17 1 #Up
            15   14  18 1
            16   14  19 1 #Down
            17   15  20 1
            18   16  21 1
            19   18  22 1
            20   20  23 1
            21   22  24 1
            22   23  25 1 #Up
            23   24  26 1
            24   26  27 1
            25   26  28 1
            26    7  10 1
            27    8  12 1
            28   13  15 2
            29   21  23 1
            30    1   2 1
            31    1   3 1
            32   27  29 1
            33    6  30 1 #Down

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