KEGG   COMPOUND: C04379
Entry
C04379                      Compound                               
Name
9,11alpha-Epoxypregn-4-ene-3,20-dione
Formula
C21H28O3
Exact mass
328.2038
Mol weight
328.4452
Structure
Reaction
Enzyme
Brite
Lipids [BR:br08002]
 ST  Sterol lipids
  ST02 Steroids
   ST0203 C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives
    C04379  9,11alpha-Epoxypregn-4-ene-3,20-dione
Other DBs
PubChem: 7020
ChEBI: 17206
LIPIDMAPS: LMST02030160
NIKKAJI: J2.750.337C
LinkDB
KCF data

ATOM        24
            1   C1z C    17.8930  -17.8899
            2   C1y C    17.9177  -16.5486
            3   C1y C    19.0808  -18.5668
            4   C1z C    16.7241  -18.5791
            5   O2x O    16.8187  -17.2008
            6   C1x C    19.0685  -15.8286
            7   C1y C    20.3321  -17.8776
            8   C1x C    19.0931  -19.9267
            9   C2y C    16.7241  -19.9328
            10  C1x C    15.5487  -17.9085
            11  C1a C    15.7826  -17.1885
            12  C1z C    20.2683  -16.5054
            13  C1x C    22.6373  -17.8839
            14  C1x C    17.9054  -20.6098
            15  C2x C    15.5487  -20.6159
            16  C1x C    14.3920  -18.5791
            17  C1y C    21.4619  -15.8225
            18  C1a C    20.1206  -15.0472
            19  C1x C    22.6434  -16.5177
            20  C5x C    14.3920  -19.9328
            21  C5a C    21.4619  -14.4811
            22  O5x O    13.2289  -20.5973
            23  C1a C    20.3052  -13.8104
            24  O5a O    22.6250  -13.8227
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Down
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     4  10 1
            10    4  11 1 #Up
            11    6  12 1
            12    7  13 1
            13    8  14 1
            14    9  15 2
            15   10  16 1
            16   12  17 1
            17   12  18 1 #Up
            18   13  19 1
            19   15  20 1
            20   17  21 1 #Up
            21   20  22 2
            22   21  23 1
            23   21  24 2
            24    2   5 1 #Down
            25    7  12 1
            26    9  14 1
            27   16  20 1
            28   17  19 1

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