KEGG   COMPOUND: C00599Help
Entry
C00599                      Compound                               

Name
Cholest-4-en-3-one;
Cholestenone;
4-Cholesten-3-one
Formula
C27H44O
Exact mass
384.3392
Mol weight
384.6377
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid degradation
Microbial metabolism in diverse environments
Enzyme
1.1.1.145       1.1.3.6         1.3.1.3         1.3.1.22        
1.14.13.141     1.14.13.221     5.3.3.1
Other DBs
CAS: 
601-57-0
PubChem: 
ChEBI: 
ChEMBL: 
LIPIDMAPS: 
LipidBank: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        28
            1   C1x C    15.1200  -24.7100
            2   C5x C    15.1200  -26.1100
            3   C2x C    16.3324  -26.8100
            4   C2y C    17.5449  -26.1100
            5   C1z C    17.5449  -24.7100
            6   C1x C    16.3324  -24.0100
            7   C1x C    18.7573  -26.8100
            8   C1x C    19.9697  -26.1100
            9   C1y C    19.9697  -24.7100
            10  C1y C    18.7573  -24.0100
            11  C1y C    21.1822  -24.0100
            12  C1z C    21.1822  -22.6100
            13  C1x C    19.9697  -21.9100
            14  C1x C    18.7573  -22.6100
            15  O5x O    13.9076  -26.8100
            16  C1x C    23.6070  -24.0100
            17  C1x C    23.6070  -22.6100
            18  C1y C    22.3946  -21.9100
            19  C1c C    22.3946  -20.5100
            20  C1b C    23.6111  -19.8077
            21  C1b C    24.8086  -20.4992
            22  C1b C    25.9949  -19.8143
            23  C1c C    27.1867  -20.5026
            24  C1a C    28.3759  -19.8161
            25  C1a C    27.1867  -21.9097
            26  C1a C    21.1862  -19.8123
            27  C1a C    17.5449  -23.3100
            28  C1a C    21.1822  -21.2100
BOND        31
            1     1   2 1
            2     2   3 1
            3     3   4 2
            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    2  15 2
            18   11  16 1
            19   16  17 1
            20   18  17 1 #Up
            21   12  18 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   22  23 1
            27   23  24 1
            28   23  25 1
            29   19  26 1 #Down
            30    5  27 1 #Up
            31   12  28 1 #Up

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