KEGG   COMPOUND: C03205
Entry
C03205                      Compound                               
Name
11-Deoxycorticosterone;
Deoxycorticosterone;
Cortexone;
21-Hydroxy-4-pregnene-3,20-dione;
Desoxycortone;
DOC
Formula
C21H30O3
Exact mass
330.2195
Mol weight
330.4611
Structure
Remark
Same as: D07792
Reaction
Pathway
map00140  Steroid hormone biosynthesis
map01100  Metabolic pathways
map04925  Aldosterone synthesis and secretion
Module
M00108  C21-Steroid hormone biosynthesis, progesterone => corticosterone/aldosterone
Enzyme
1.1.1.145       1.3.1.22        1.14.14.16      1.14.15.4       
5.3.1.21        5.3.3.1
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  21-Carbon atoms
   Pregnane derivatives
    C03205  11-Deoxycorticosterone
 Hormones and transmitters
  Steroid hormones
   Mineralocorticoids
    C03205  11-Deoxycorticosterone
Lipids [BR:br08002]
 ST  Sterol lipids
  ST02 Steroids
   ST0203 C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives
    C03205  11-Deoxycorticosterone
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H02 CORTICOSTEROIDS FOR SYSTEMIC USE
   H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
    H02AA Mineralocorticoids
     H02AA03 Desoxycortone
      D07792  Desoxycortone (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C2 (MR)
     D07792  Desoxycortone (INN)
Other DBs
CAS: 64-85-7
PubChem: 6081
ChEBI: 16973
LIPIDMAPS: LMST02030087
PDB-CCD: 1CA[PDBj]
3DMET: B01638
NIKKAJI: J1.407I
KCF data

ATOM        24
            1   C1y C    27.3191  -16.5320
            2   C1y C    26.0345  -17.2153
            3   C1z C    27.2668  -15.1304
            4   C1y C    24.8257  -16.5086
            5   C1x C    26.0345  -18.6167
            6   C1x C    26.0579  -14.4179
            7   C1z C    23.6109  -17.2036
            8   C1x C    24.8374  -15.1129
            9   C1x C    24.8140  -19.3175
            10  C2y C    23.6051  -18.6110
            11  C1x C    22.3963  -16.5086
            12  C1a C    23.5934  -15.8078
            13  C2x C    22.3963  -19.3175
            14  C1x C    21.1816  -17.2036
            15  C5x C    21.1816  -18.6110
            16  O5x O    19.9669  -19.3175
            17  C1x C    29.6723  -16.5114
            18  C1x C    29.6899  -15.0398
            19  C1y C    28.4522  -14.3856
            20  C5a C    28.4004  -13.0201
            21  C1a C    27.2668  -13.7304
            22  O5a O    27.1776  -12.3746
            23  C1b C    29.5994  -12.2657
            24  O1a O    30.8392  -12.9201
BOND        27
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 1
            8     5   9 1
            9     7  10 1
            10    7  11 1
            11    7  12 1 #Up
            12   10  13 2
            13   11  14 1
            14   13  15 1
            15   15  16 2
            16    6   8 1
            17    9  10 1
            18   14  15 1
            19    1  17 1
            20   17  18 1
            21   18  19 1
            22    3  19 1
            23   19  20 1 #Up
            24    3  21 1 #Up
            25   20  22 2
            26   20  23 1
            27   23  24 1

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