KEGG   COMPOUND: C11135Help
Entry
C11135                      Compound                               

Name
Androsterone glucuronide;
Androsterone 3-glucuronide
Formula
C25H38O8
Exact mass
466.2567
Mol weight
466.5644
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid hormone biosynthesis
Enzyme
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C11135  Androsterone 3-glucuronide
  ST05 Steroid conjugates
   ST0501 Glucuronides
    C11135  Androsterone 3-glucuronide
BRITE hierarchy
Other DBs
CAS: 
1852-43-3
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        33
            1   C1y C    23.4349  -18.6918
            2   C1y C    23.4349  -20.0834
            3   C1y C    24.6421  -20.7756
            4   C1y C    25.8422  -20.0834
            5   C1y C    25.8422  -18.6918
            6   O2x O    24.6421  -17.9925
            7   C1y C    33.2659  -15.8056
            8   C1y C    32.1112  -15.1542
            9   C1y C    34.4030  -15.1425
            10  C1x C    33.2717  -17.1451
            11  C1z C    31.0430  -15.8173
            12  C1x C    32.1054  -13.8333
            13  C1z C    34.3971  -13.8333
            14  C1x C    36.7135  -15.1483
            15  C1x C    32.1229  -17.8072
            16  C1y C    30.9788  -17.1451
            17  C1x C    29.8185  -15.1717
            18  C1a C    30.8854  -14.2065
            19  C1x C    33.2483  -13.1701
            20  C5x C    35.5472  -13.1584
            21  C1a C    34.2908  -12.3276
            22  C1x C    36.7018  -13.8087
            23  C1x C    29.8359  -17.8189
            24  C1x C    28.6754  -15.8420
            25  O5x O    35.5413  -11.7780
            26  C1y C    28.6814  -17.1627
            27  O2a O    27.2411  -17.8904
            28  O1a O    24.6439  -22.1674
            29  C6a C    22.2310  -17.9918
            30  O1a O    22.2310  -20.7763
            31  O1a O    27.0470  -20.7748
            32  O6a O    22.2317  -16.6002
            33  O6a O    21.0265  -18.6905
BOND        37
            1     3   4 1
            2     7   8 1
            3     7   9 1
            4     7  10 1
            5     8  11 1
            6     8  12 1
            7     9  13 1
            8     9  14 1
            9    10  15 1
            10   11  16 1
            11   11  17 1
            12   11  18 1 #Up
            13   12  19 1
            14   13  20 1
            15   13  21 1 #Up
            16   14  22 1
            17   16  23 1
            18   17  24 1
            19   20  25 2
            20   23  26 1
            21   26  27 1 #Down
            22   13  19 1
            23   15  16 1
            24   20  22 1
            25   24  26 1
            26    5  27 1 #Up
            27    4   5 1
            28    3  28 1 #Up
            29    5   6 1
            30    1  29 1 #Up
            31    6   1 1
            32    2  30 1 #Down
            33    4  31 1 #Down
            34    1   2 1
            35   29  32 2
            36    2   3 1
            37   29  33 1

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