KEGG   COMPOUND: C00762Help
Entry
C00762                      Compound                               

Name
Cortisone;
17alpha,21-Dihydroxy-4-pregnene-3,11,20-trione;
Kendall's compound E;
Reichstein's substance Fa
Formula
C21H28O5
Exact mass
360.1937
Mol weight
360.444
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Steroid hormone biosynthesis
Metabolic pathways
Aldosterone-regulated sodium reabsorption
Pathways in cancer
Prostate cancer
Glucocorticoid and meneralocorticoid receptor agonists/antagonists
Module
M00109  
C21-Steroid hormone biosynthesis, progesterone => cortisol/cortisone
Enzyme
1.1.1.146       1.1.1.-         1.3.1.3         1.3.1.22
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  21-Carbon atoms
   Pregnane and derivatives
    C00762  Cortisone
 Hormones and transmitters
  Steroid hormones
   Glucocorticoids
    C00762  Cortisone
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0203 C21 steroids (gluco/mineralocorticoids, progestogens) and derivatives
    C00762  Cortisone
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
    H02AB Glucocorticoids
     H02AB10 Cortisone
      D07749  Cortisone (INN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01B ANTIINFLAMMATORY AGENTS
    S01BA Corticosteroids, plain
     S01BA03 Cortisone
      D07749  Cortisone (INN)
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Adrenal)
  Cortisone
   D07749  Cortisone (INN)
 Inflammatory Bowel Disease Agents
  Glucocorticoids
   Cortisone
    D07749  Cortisone (INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    glucocorticoid receptor
     Cortisone
      D07749  Cortisone (INN)
Cytochrome P450 interactions [BR:br08309]
 Substrates
  CYP3A4
   Cortisone
    D07749  Cortisone (INN)
  CYP3A5
   Cortisone
    D07749  Cortisone (INN)
BRITE hierarchy
Other DBs
CAS: 
53-06-5
PubChem: 
ChEBI: 
LIPIDMAPS: 
LipidBank: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   C1x C     5.6756  -16.9748
            2   C5x C     5.6756  -18.3385
            3   C2x C     6.8565  -19.0203
            4   C2y C     8.0376  -18.3385
            5   C1z C     8.0376  -16.9748
            6   C1x C     6.8565  -16.2929
            7   C1x C     9.2185  -19.0203
            8   C1x C    10.3994  -18.3385
            9   C1y C    10.3994  -16.9748
            10  C1y C     9.2185  -16.2929
            11  C1y C    11.5805  -16.2929
            12  C1z C    11.5805  -14.9293
            13  C1x C    10.3994  -14.2474
            14  C5x C     9.2185  -14.9293
            15  C1x C    13.9424  -16.2929
            16  C1x C    13.9424  -14.9293
            17  C1z C    12.7614  -14.2474
            18  C1a C     8.0376  -15.6111
            19  C1a C    11.5805  -13.5656
            20  C5a C    12.7614  -12.5429
            21  O5x O     4.4946  -19.0203
            22  O5x O     8.0395  -14.2486
            23  C1b C    13.9464  -11.8588
            24  O5a O    11.5844  -11.8633
            25  O1a O    13.9424  -13.5656
            26  O1a O    15.1128  -12.5323
BOND        29
            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   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21    5  18 1 #Up
            22   12  19 1 #Up
            23   17  20 1 #Up
            24    2  21 2
            25   14  22 2
            26   20  23 1
            27   20  24 2
            28   17  25 1 #Down
            29   23  26 1

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