KEGG   COMPOUND: C11134Help
Entry
C11134                      Compound                               

Name
Testosterone glucuronide;
Testosterone 17beta-(beta-D-glucuronide)
Formula
C25H36O8
Exact mass
464.241
Mol weight
464.5485
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
    C11134  Testosterone 17beta-(beta-D-glucuronide)
  ST05 Steroid conjugates
   ST0501 Glucuronides
    C11134  Testosterone glucuronide
BRITE hierarchy
Other DBs
CAS: 
1180-25-2
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        33
            1   C1y C    31.6541  -15.4755
            2   C1y C    32.8602  -16.1738
            3   C1y C    34.0681  -15.4784
            4   C1y C    34.0696  -14.0846
            5   C1y C    32.8634  -13.3863
            6   O2x O    31.6558  -14.0818
            7   C1y C    28.3530  -20.5981
            8   C1y C    27.1680  -19.9384
            9   C1y C    29.5089  -19.9267
            10  C1x C    28.3588  -21.9524
            11  C1z C    26.0064  -20.6155
            12  C1x C    27.1622  -18.5900
            13  C1z C    29.5672  -18.5841
            14  C1x C    31.8730  -19.9267
            15  C1x C    27.1854  -22.6469
            16  C2y C    26.0238  -21.9698
            17  C1x C    24.8388  -19.9501
            18  C1a C    26.0004  -19.2729
            19  C1x C    28.3296  -17.9129
            20  C1y C    30.6763  -17.8895
            21  C1a C    29.4855  -17.1714
            22  C1x C    31.8555  -18.5724
            23  C2x C    24.8505  -22.6586
            24  C1x C    23.6655  -20.6272
            25  O2a O    30.6705  -16.4768
            26  C5x C    23.6714  -21.9815
            27  O5x O    22.4630  -22.6820
            28  C6a C    32.8651  -11.9897
            29  O1a O    35.2800  -13.3877
            30  O1a O    32.8585  -17.5704
            31  O1a O    35.2766  -16.1780
            32  O6a O    31.6470  -11.2857
            33  O6a O    34.0752  -11.2924
BOND        37
            1     2   3 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 2
            18   17  24 1
            19   20  25 1 #Up
            20   23  26 1
            21   26  27 2
            22   13  19 1
            23   15  16 1
            24   20  22 1
            25   24  26 1
            26    1  25 1 #Down
            27    3   4 1
            28    5  28 1 #Down
            29    4   5 1
            30    4  29 1 #Up
            31    5   6 1
            32    2  30 1 #Up
            33    6   1 1
            34    3  31 1 #Down
            35   28  32 1
            36    1   2 1
            37   28  33 2

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