KEGG   COMPOUND: C05464Help
Entry
C05464                      Compound                               

Name
Glycodeoxycholate;
Glycodeoxycholic acid;
3alpha,12alpha-Dihydroxy-5beta-cholan-24-oylglycine
Formula
C26H43NO5
Exact mass
449.3141
Mol weight
449.6233
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Enzyme
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST04 Bile acids and derivatives
   ST0402 C26 bile acids, alcohols, and derivatives
    C05464  Glycodeoxycholic acid
  ST05 Steroid conjugates
   ST0503 Glycine conjugates
    C05464  Glycodeoxycholate
BRITE hierarchy
Other DBs
CAS: 
360-65-6
PubChem: 
ChEBI: 
LIPIDMAPS: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        32
            1   C1y C    27.2042  -19.6165
            2   C1y C    26.0230  -20.2938
            3   C1z C    27.2215  -18.2557
            4   C1x C    29.5492  -19.5753
            5   C1y C    24.8534  -19.5990
            6   C1x C    26.0230  -21.6546
            7   C1y C    28.4027  -17.5956
            8   C1y C    26.0461  -17.5725
            9   C1a C    27.2098  -17.0342
            10  C1x C    29.5665  -18.2848
            11  C1z C    23.6665  -20.2822
            12  C1x C    24.8654  -18.2384
            13  C1x C    24.8418  -22.3261
            14  C1c C    28.3968  -16.2292
            15  O1a O    26.0345  -16.2003
            16  C1y C    23.6607  -21.6429
            17  C1x C    22.4910  -19.5932
            18  C1a C    23.6491  -18.9157
            19  C1b C    29.5722  -15.5344
            20  C1a C    27.2098  -14.9201
            21  C1x C    22.4910  -22.3203
            22  C1x C    21.2984  -20.2822
            23  C1b C    30.7534  -16.2234
            24  C1y C    21.2984  -21.6429
            25  C5a C    31.9288  -15.5344
            26  O1a O    20.1172  -22.3146
            27  N1b N    33.1099  -16.2234
            28  O5a O    31.9288  -14.1737
            29  C1b C    34.2852  -15.5344
            30  C6a C    35.4665  -16.2234
            31  O6a O    36.6419  -15.5344
            32  O6a O    35.4665  -17.5841
BOND        35
            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    8  15 1 #Down
            15   11  16 1
            16   11  17 1
            17   11  18 1 #Up
            18   14  19 1
            19   14  20 1 #Down
            20   16  21 1
            21   17  22 1
            22   19  23 1
            23   21  24 1
            24   23  25 1
            25   24  26 1 #Down
            26   25  27 1
            27   25  28 2
            28   27  29 1
            29   29  30 1
            30   30  31 1
            31   30  32 2
            32    7  10 1
            33    8  12 1
            34   13  16 1
            35   22  24 1

» Japanese version

DBGET integrated database retrieval system