KEGG   COMPOUND: C04844Help
Entry
C04844                      Compound                               

Name
3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate;
(1E,2Z)-3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate;
DSHA
Formula
C19H24O6
Exact mass
348.1573
Mol weight
348.3903
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid degradation
Metabolic pathways
Microbial metabolism in diverse environments
Degradation of aromatic compounds
Enzyme
1.13.11.25      3.7.1.17
Brite
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C04844  3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-1(10),2-dien-4-oate
BRITE hierarchy
Other DBs
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C1y C    19.7883  -12.8122
            2   C1z C    19.7824  -11.4657
            3   C1y C    18.6403  -13.4804
            4   C1x C    22.1272  -12.8122
            5   C5x C    20.9431  -10.7855
            6   C1x C    18.6215  -10.8030
            7   C1a C    19.7679  -10.0897
            8   C5x C    17.4608  -12.8238
            9   C1b C    18.6462  -14.8244
            10  C1x C    22.1155  -11.4540
            11  O5x O    20.9372   -9.3937
            12  C1x C    17.4549  -11.4787
            13  O5x O    16.2995  -13.5582
            14  C1b C    17.4853  -15.5069
            15  C5a C    17.4736  -16.8450
            16  C2c C    16.3115  -17.5134
            17  C2b C    16.3232  -18.8646
            18  O5a O    18.6724  -17.5386
            19  C1a C    15.1067  -16.8301
            20  C2b C    15.1107  -19.5646
            21  C2c C    15.1107  -20.9646
            22  O1a O    16.3232  -21.6646
            23  C6a C    13.9202  -21.6514
            24  O6a O    12.7062  -20.9500
            25  O6a O    13.9199  -23.0300
BOND        26
            1     3   9 1
            2     4  10 1
            3     5  11 2
            4     6  12 1
            5     8  13 2
            6     9  14 1
            7    14  15 1
            8    15  16 1
            9    16  17 2
            10    5  10 1
            11    8  12 1
            12   15  18 2
            13    1   2 1
            14   16  19 1
            15    1   3 1
            16    1   4 1
            17    2   5 1
            18    2   6 1
            19    2   7 1 #Up
            20    3   8 1
            21   17  20 1
            22   20  21 2
            23   21  22 1
            24   21  23 1
            25   23  24 1
            26   23  25 2

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