KEGG   COMPOUND: C11246
Entry
C11246                      Compound                               
Name
6alpha-Glucuronosylhyodeoxycholate
Formula
C30H47O10
Exact mass
567.3169
Mol weight
567.6882
Structure
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST05 Steroid conjugates
   ST0501 Glucuronides
    C11246  6alpha-Glucuronosylhyodeoxycholate
Other DBs
PubChem: 13424
ChEBI: 137822
LIPIDMAPS: LMST05010016
3DMET: B04214
NIKKAJI: J960.895H
KCF data

ATOM        40
            1   O2a O    26.6036  -20.1262
            2   O2x O    25.4194  -22.2973
            3   C1y C    25.4194  -23.6778
            4   C1y C    26.6160  -24.3610
            5   C1y C    27.8126  -23.6778
            6   C1y C    27.8126  -22.2973
            7   C1y C    26.6160  -21.6002
            8   C6a C    24.2263  -24.3617
            9   O6a O    23.0252  -23.6791 #-
            10  O6a O    24.2270  -25.7422
            11  O1a O    26.6178  -25.7415
            12  O1a O    29.0066  -24.3602
            13  O1a O    29.0066  -21.6010
            14  C1y C    27.7869  -16.6776
            15  C1y C    28.9887  -15.9827
            16  C1y C    26.6024  -15.9886
            17  C1x C    27.7869  -18.0484
            18  C1z C    29.0063  -14.6292
            19  C1x C    31.3856  -15.9419
            20  C1z C    25.3945  -16.6776
            21  C1x C    26.6024  -14.6116
            22  C1y C    26.6024  -18.7246
            23  C1y C    30.1779  -13.9822
            24  C1x C    27.7869  -13.9355
            25  C1a C    29.0237  -13.2641
            26  C1x C    31.3273  -14.6642
            27  C1y C    25.3829  -18.0310
            28  C1x C    24.2160  -15.9886
            29  C1a C    25.3945  -15.2949
            30  C1c C    30.2012  -12.6172
            31  C1x C    24.1986  -18.7072
            32  C1x C    23.0083  -16.6776
            33  C1b C    31.3915  -11.9456
            34  C1a C    29.0179  -11.6133
            35  C1y C    23.0607  -18.0310
            36  C1b C    32.5643  -12.6522
            37  O1a O    21.7829  -18.7072
            38  C6a C    33.7604  -11.9875
            39  O6a O    34.9331  -12.6870
            40  O6a O    33.7078  -10.6224
BOND        44
            1     5   6 1
            2     6   7 1
            3     7   2 1
            4     3   8 1 #Up
            5     8   9 1
            6     8  10 2
            7     4  11 1 #Down
            8     5  12 1 #Up
            9     6  13 1 #Down
            10    7   1 1 #Up
            11    2   3 1
            12    3   4 1
            13    4   5 1
            14   14  15 1
            15   14  16 1
            16   14  17 1
            17   15  18 1
            18   15  19 1
            19   16  20 1
            20   16  21 1
            21   17  22 1
            22   18  23 1
            23   18  24 1
            24   18  25 1 #Up
            25   19  26 1
            26   20  27 1
            27   20  28 1
            28   20  29 1 #Up
            29   23  30 1
            30   27  31 1
            31   28  32 1
            32   30  33 1
            33   30  34 1 #Down
            34   31  35 1
            35   33  36 1
            36   35  37 1 #Down
            37   36  38 1
            38   38  39 1
            39   38  40 2
            40   21  24 1
            41   22  27 1
            42   23  26 1
            43   32  35 1
            44   22   1 1 #Down

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