KEGG   COMPOUND: C01227Help
Entry
C01227                      Compound                               

Name
Dehydroepiandrosterone;
3beta-Hydroxyandrost-5-en-17-one;
Dehydroisoandrosterone;
DHA;
DHEA
Formula
C19H28O2
Exact mass
288.2089
Mol weight
288.4244
Structure
Mol fileKCF fileDB search
Remark
Same as: D08409
Reaction
Pathway
map00140  Steroid hormone biosynthesis
map00984  Steroid degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map04913  Ovarian steroidogenesis
map05200  Pathways in cancer
map05215  Prostate cancer
Module
M00110  C19/C18-Steroid hormone biosynthesis, pregnenolone => androstenedione => estrone
Enzyme
1.1.1.51        1.1.1.145       1.14.13.-       1.14.14.1       
1.14.14.23      1.14.14.32      2.8.2.2         3.1.6.2         
5.3.3.1
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  19-Carbon atoms
   Androstane derivatives
    C01227  Dehydroepiandrosterone
 Hormones and transmitters
  Steroid hormones
   Androgens
    C01227  Dehydroepiandrosterone
Lipids [BR:br08002]
 ST  Sterol Lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C01227  3beta-Hydroxyandrost-5-en-17-one
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A14 ANABOLIC AGENTS FOR SYSTEMIC USE
   A14A ANABOLIC STEROIDS
    A14AA Androstan derivatives
     A14AA07 Prasterone
      D08409  Prasterone (INN) <US>
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   Estrogen receptor
    NR3A (ESR)
     D08409  Prasterone (INN) <US>
   3-Ketosteroid receptor
    NR3C4 (AR)
     D08409  Prasterone (INN) <US>
BRITE hierarchy
Other DBs
CAS: 53-43-0
PubChem: 4449
ChEBI: 28689
ChEMBL: CHEMBL309821 CHEMBL363554 CHEMBL90593
LIPIDMAPS: LMST02020021
LipidBank: SST0185
PDB-CCD: AND[PDBj]
3DMET: B01415
NIKKAJI: J4.147E
KCF data Show

ATOM        21
            1   C1y C    30.0061  -18.0011
            2   C1y C    28.8345  -17.3309
            3   C1y C    31.1833  -17.3076
            4   C1x C    30.0177  -19.3592
            5   C1z C    27.6745  -18.0070
            6   C1x C    28.8577  -15.9611
            7   C1z C    31.1192  -15.9554
            8   C1x C    33.5380  -17.2900
            9   C2x C    28.8462  -20.0237
            10  C2y C    27.6745  -19.3533
            11  C1x C    26.5206  -17.3483
            12  C1a C    27.6921  -16.4975
            13  C1x C    30.0001  -15.2734
            14  C5x C    32.3724  -15.2676
            15  C1a C    31.1833  -14.3001
            16  C1x C    33.5497  -15.9611
            17  C1x C    26.5089  -20.0237
            18  C1x C    25.3491  -18.0070
            19  O5x O    32.3665  -13.9445
            20  C1y C    25.3491  -19.3533
            21  O1a O    24.2066  -20.0061
BOND        24
            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 #Up
            15    8  16 1
            16   10  17 1
            17   11  18 1
            18   14  19 2
            19   17  20 1
            20   20  21 1 #Up
            21    7  13 1
            22    9  10 2
            23   14  16 1
            24   18  20 1

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