KEGG   COMPOUND: C00535
Entry
C00535                      Compound                               
Name
Testosterone;
17beta-Hydroxy-4-androsten-3-one
Formula
C19H28O2
Exact mass
288.2089
Mol weight
288.42
Structure
Remark
Same as: D00075
Reaction
R01836 R01838 R02497 R02498 R02499 R02501 R02502 R02503
R10511 R11349
Pathway
map00140  Steroid hormone biosynthesis
map00984  Steroid degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01522  Endocrine resistance
map04913  Ovarian steroidogenesis
map04929  GnRH secretion
map05200  Pathways in cancer
map05215  Prostate cancer
map07226  Progesterone, androgen and estrogen receptor agonists/antagonists
Module
M00976  C19-Steroid hormone biosynthesis, pregnenolone => testosterone => dihydrotestosterone
Network
nt06019  Steroid hormone biosynthesis
nt06227  Nuclear receptor signaling (cancer)
nt06272  Prostate cancer
Enzyme
1.1.1.51        1.1.1.64        1.1.1.145       1.1.1.239       
1.3.1.3         1.3.1.22        1.14.14.1       1.14.14.14      
1.14.15.19      2.4.1.17        5.3.3.1
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  19-Carbon atoms
   Androstane derivatives
    C00535  Testosterone
 Hormones and transmitters
  Steroid hormones
   Androgens
    C00535  Testosterone
Lipids [BR:br08002]
 ST  Sterol lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C00535  17beta-Hydroxy-4-androsten-3-one
Phytochemical compounds [BR:br08003]
 Terpenoids
  Steroids
   Androstane
    C00535  Testosterone
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
   G03B ANDROGENS
    G03BA 3-oxoandrosten (4) derivatives
     G03BA03 Testosterone
      D00075  Testosterone (JAN/USP) <US>
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Sex Hormones/Modifiers)
  Androgens
   Testosterone
    D00075  Testosterone (JAN/USP)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for  urogenital organs and anus
  31 Other drugs for  urogenital organs and anus
   D00075  Testosterone (JAN/USP)
 Agents for integumentary system
  61 Other agents for integumentary system
   D00075  Testosterone (JAN/USP)
Risk category of Japanese OTC drugs [BR:br08312]
 First-class OTC drugs
  Inorganic and organic chemicals
   Testosterone
    D00075  Testosterone (JAN/USP)
Drug groups [BR:br08330]
 Hormonal agent
  DG01590  Androgen receptor agonist
   DG00460  Testosterone
    D00075  Testosterone
  DG02006  Testosterone
   DG00460  Testosterone
    D00075  Testosterone
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C4 (AR)
     D00075  Testosterone (JAN/USP) <US>
Other DBs
CAS: 58-22-0
PubChem: 3817
ChEBI: 17347
LIPIDMAPS: LMST02020002
KNApSAcK: C00003675
PDB-CCD: TES[PDBj]
NIKKAJI: J4.590J
LinkDB
KCF data

ATOM        21
            1   C1x C    28.4900  -18.2000
            2   C5x C    28.4900  -19.6000
            3   C2x C    29.6800  -20.2300
            4   C2y C    30.8700  -19.6000
            5   C1z C    30.8700  -18.2000
            6   C1x C    29.6800  -17.5000
            7   C1x C    32.0600  -20.2300
            8   C1x C    33.1800  -19.6000
            9   C1y C    33.1800  -18.2000
            10  C1y C    32.0600  -17.5000
            11  C1y C    34.4400  -17.5000
            12  C1z C    34.4400  -16.1700
            13  C1x C    33.1800  -15.4700
            14  C1x C    32.0600  -16.1700
            15  O5x O    27.3700  -20.2300
            16  C1a C    34.4400  -14.8400
            17  C1a C    30.8700  -16.8700
            18  C1x C    36.8200  -17.5000
            19  C1x C    36.8200  -16.1700
            20  C1y C    35.6300  -15.4700
            21  O1a O    35.6300  -14.1400
BOND        24
            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    2  15 2
            18   12  16 1 #Up
            19    5  17 1 #Up
            20   11  18 1
            21   18  19 1
            22   19  20 1
            23   12  20 1
            24   20  21 1 #Up

» Japanese version

KEGG   COMPOUND: C00280
Entry
C00280                      Compound                               
Name
Androstenedione;
Androst-4-ene-3,17-dione;
4-Androstene-3,17-dione
Formula
C19H26O2
Exact mass
286.1933
Mol weight
286.41
Structure
Remark
Same as: D00051
Reaction
R01833 R01834 R01835 R01836 R01837 R01838 R01840 R01842
R02725 R08205 R08206 R08518 R09884 R09919 R09955 R10242
R10515
Pathway
map00140  Steroid hormone biosynthesis
map00984  Steroid degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01522  Endocrine resistance
map04913  Ovarian steroidogenesis
map04917  Prolactin signaling pathway
map05200  Pathways in cancer
map05215  Prostate cancer
Module
M00110  C19/C18-Steroid hormone biosynthesis, pregnenolone => androstenedione => estrone
M00976  C19-Steroid hormone biosynthesis, pregnenolone => testosterone => dihydrotestosterone
Network
nt06019  Steroid hormone biosynthesis
nt06227  Nuclear receptor signaling (cancer)
nt06272  Prostate cancer
Enzyme
1.1.1.51        1.1.1.64        1.1.1.145       1.1.1.239       
1.3.1.3         1.3.1.22        1.3.99.4        1.3.99.5        
1.14.13.54      1.14.14.1       1.14.14.14      1.14.14.32      
1.14.15.4       1.14.99.12      5.3.3.1
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  19-Carbon atoms
   Androstane derivatives
    C00280  Androstenedione
 Hormones and transmitters
  Steroid hormones
   Androgens
    C00280  Androstenedione
Lipids [BR:br08002]
 ST  Sterol lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C00280  Androst-4-ene-3,17-dione
Phytochemical compounds [BR:br08003]
 Terpenoids
  Steroids
   Androstane
    C00280  Androstenedione
Other DBs
CAS: 63-05-8
PubChem: 3575
ChEBI: 16422
LIPIDMAPS: LMST02020007
KNApSAcK: C00003644
PDB-CCD: ASD[PDBj]
NIKKAJI: J38.388K
LinkDB
KCF data

ATOM        21
            1   C1x C    19.6989  -15.2222
            2   C5x C    19.6989  -16.5853
            3   C2x C    20.8793  -17.2668
            4   C2y C    22.0598  -16.5853
            5   C1z C    22.0598  -15.2222
            6   C1x C    20.8793  -14.5407
            7   C1x C    23.2402  -17.2668
            8   C1x C    24.4206  -16.5853
            9   C1y C    24.4206  -15.2222
            10  C1y C    23.2402  -14.5407
            11  C1y C    25.6011  -14.5407
            12  C1z C    25.6011  -13.1776
            13  C1x C    24.4206  -12.4961
            14  C1x C    23.2402  -13.1776
            15  C1x C    27.9619  -14.5407
            16  C1x C    27.9619  -13.1776
            17  C5x C    26.7815  -12.4961
            18  O5x O    18.5185  -17.2668
            19  O5x O    26.7815  -11.1331
            20  C1a C    22.0598  -13.8592
            21  C1a C    25.6011  -11.8146
BOND        24
            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    2  18 2
            22   17  19 2
            23    5  20 1 #Up
            24   12  21 1 #Up

» Japanese version

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