KEGG   COMPOUND: C05497Help
Entry
C05497                      Compound                               

Name
21-Deoxycortisol;
4-Pregnene-11beta,17alpha-diol-3,20-dione;
11beta,17alpha-Dihydroxyprogesterone
Formula
C21H30O4
Exact mass
346.2144
Mol weight
346.4605
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Steroid hormone biosynthesis
Enzyme
1.14.14.16      1.14.14.19      1.14.15.4
Brite
Compounds with biological roles [BR:br08001]
 Hormones and transmitters
  Steroid hormones
   Glucocorticoids
    C05497  21-Deoxycortisol
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0203 C21 steroids (gluco/mineralocorticoids, progestogens) and derivatives
    C05497  21-Deoxycortisol
BRITE hierarchy
Other DBs
CAS: 
641-77-0
PubChem: 
ChEBI: 
LIPIDMAPS: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C1y C    19.8292  -17.5614
            2   C1y C    21.0257  -16.8611
            3   C1y C    18.6444  -16.8844
            4   C1x C    19.8350  -18.9389
            5   C1z C    21.0315  -15.4894
            6   C1x C    23.4127  -16.8026
            7   C1z C    17.4654  -17.5731
            8   C1y C    18.6328  -15.5070
            9   C1x C    18.6502  -19.6100
            10  C1z C    22.2222  -14.8007
            11  C1x C    19.8233  -14.8066
            12  C1a C    21.0257  -14.1412
            13  C1x C    23.4127  -15.5011
            14  C2y C    17.4654  -18.9330
            15  C1x C    16.2805  -16.9018
            16  C1a C    17.4537  -16.2248
            17  O1a O    17.4186  -14.8183
            18  C5a C    22.1579  -13.4582
            19  O1a O    23.2726  -13.9894
            20  C2x C    16.2805  -19.6159
            21  C1x C    15.1191  -17.5731
            22  C1a C    23.3894  -12.7929
            23  O5a O    21.0608  -12.7812
            24  C5x C    15.1191  -18.9330
            25  O5x O    13.9517  -19.5983
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    5  12 1 #Up
            12    6  13 1
            13    7  14 1
            14    7  15 1
            15    7  16 1 #Up
            16    8  17 1 #Up
            17   10  18 1
            18   10  19 1 #Down
            19   14  20 2
            20   15  21 1
            21   18  22 1
            22   18  23 2
            23   20  24 1
            24   24  25 2
            25    8  11 1
            26    9  14 1
            27   10  13 1
            28   21  24 1

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