KEGG   COMPOUND: C05417
Entry
C05417                      Compound                               
Name
5,6beta-Epoxy-5beta-cholestane
Formula
C27H46O
Exact mass
386.3549
Mol weight
386.6535
Structure
Reaction
Enzyme
1.14.13.-       3.3.2.-
Other DBs
PubChem: 7782
ChEBI: 28033
NIKKAJI: J2.755.870D
LinkDB
KCF data

ATOM        28
            1   C1x C    18.5813  -19.3005
            2   C1x C    18.5813  -20.6723
            3   C1x C    19.7692  -21.3582
            4   C1z C    20.9573  -20.6723
            5   C1z C    20.9573  -19.3005
            6   C1x C    19.7692  -18.6147
            7   C1y C    22.1452  -21.3582
            8   C1x C    23.3331  -20.6723
            9   C1y C    23.3331  -19.3005
            10  C1y C    22.1452  -18.6147
            11  C1y C    24.5211  -18.6147
            12  C1z C    24.5211  -17.2429
            13  C1x C    23.3331  -16.5571
            14  C1x C    22.1452  -17.2429
            15  C1x C    26.8970  -18.6147
            16  C1x C    26.8970  -17.2429
            17  C1y C    25.7091  -16.5571
            18  C1a C    20.9573  -17.9288
            19  O2x O    20.9573  -22.0440
            20  C1c C    25.7091  -15.1853
            21  C1b C    26.9023  -14.4995
            22  C1b C    28.0903  -15.1853
            23  C1b C    29.2782  -14.4995
            24  C1c C    30.4662  -15.1853
            25  C1a C    31.6542  -14.4995
            26  C1a C    24.5257  -14.5006
            27  C1a C    24.5211  -15.8712
            28  C1a C    30.4662  -16.5570
BOND        32
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21    5  18 1 #Up
            22    4  19 1 #Up
            23   17  20 1
            24   20  21 1
            25   21  22 1
            26   22  23 1
            27   23  24 1
            28   24  25 1
            29   20  26 1 #Down
            30   12  27 1 #Up
            31    7  19 1 #Up
            32   24  28 1

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