KEGG   COMPOUND: C05454
Entry
C05454                      Compound                               
Name
3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestane;
5beta-Cholestane-3alpha,7alpha,12alpha-triol;
3alpha,7alpha,12alpha-Trihydroxycoprostane
Formula
C27H48O3
Exact mass
420.3603
Mol weight
420.67
Structure
Reaction
R04807 R04824 R04825 R07204 R11142
Pathway
map00120  Primary bile acid biosynthesis
map01100  Metabolic pathways
Module
M00104  Bile acid biosynthesis, cholesterol => cholate/chenodeoxycholate
Enzyme
1.1.1.50        1.14.14.139     1.14.15.15
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST04 Bile acids and derivatives
   ST0403 C27 bile acids, alcohols, and derivatives
    C05454  3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestane
Other DBs
CAS: 547-96-6
PubChem: 7816
ChEBI: 16496
LIPIDMAPS: LMST04030035
NIKKAJI: J40.089K
KCF data

ATOM        30
            1   C1y C    26.4000  -20.9268
            2   C1y C    25.2302  -21.6019
            3   C1z C    26.4000  -19.5766
            4   C1x C    28.7396  -20.9268
            5   C1y C    24.0661  -20.9268
            6   C1y C    25.2243  -22.9522
            7   C1y C    27.5815  -18.9014
            8   C1y C    25.2302  -18.9014
            9   C1a C    26.3957  -18.3669
            10  C1x C    28.7396  -19.5766
            11  C1z C    22.8847  -21.6019
            12  C1x C    24.0661  -19.5766
            13  C1x C    24.0661  -23.6272
            14  C1c C    27.5815  -16.9912
            15  C1y C    22.8847  -22.9522
            16  C1x C    21.7207  -20.9268
            17  C1a C    22.8730  -20.2517
            18  C1b C    28.7746  -16.3044
            19  C1a C    26.3825  -16.2987
            20  C1x C    21.7207  -23.6272
            21  C1x C    20.5510  -21.6019
            22  C1b C    29.9677  -16.9970
            23  C1y C    20.5510  -22.9522
            24  C1b C    31.1608  -16.3044
            25  O1a O    19.3695  -23.6272
            26  C1c C    32.3597  -16.9970
            27  C1a C    33.5527  -16.3101
            28  C1a C    32.3539  -18.3764
            29  O1a O    26.4303  -23.6483
            30  O1a O    25.2192  -17.5090
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 #Down
            23   24  26 1
            24   26  27 1
            25   26  28 1
            26    7  10 1
            27    8  12 1
            28   13  15 1
            29   21  23 1
            30    1   2 1
            31    6  29 1 #Down
            32    1   3 1
            33    8  30 1 #Down

» Japanese version

  All links  
Pathway (3)   
   KEGG PATHWAY (2)   
   KEGG MODULE (1)   
Chemical substance (5)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   LIPIDMAPS (1)   
   NIKKAJI (1)   
Chemical reaction (8)   
   KEGG ENZYME (3)   
   KEGG REACTION (5)   
Gene (1573)   
   KEGG GENES (1573)   
All databases (1589)   

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