KEGG   COMPOUND: C03772
Entry
C03772                      Compound                               
Name
5beta-Androstane-3,17-dione
Formula
C19H28O2
Exact mass
288.2089
Mol weight
288.4244
Structure
Reaction
R01835 R04309 R04310
Pathway
map00140  Steroid hormone biosynthesis
Enzyme
1.1.1.50        1.1.1.152       1.3.1.3
Brite
Compounds with biological roles [BR:br08001]
 Steroids
  19-Carbon atoms
   Androstane derivatives
    C03772  5beta-Androstane-3,17-dione
Lipids [BR:br08002]
 ST  Sterol lipids
  ST02 Steroids
   ST0202 C19 steroids (androgens) and derivatives
    C03772  5beta-Androstane-3,17-dione
Other DBs
CAS: 1229-12-5
PubChem: 6526
ChEBI: 16985
LIPIDMAPS: LMST02020058
PDB-CCD: ANO[PDBj]
3DMET: B01689
NIKKAJI: J38.550F
LinkDB
KCF data

ATOM        21
            1   C1y C    27.7637  -21.2760
            2   C1y C    26.6164  -20.5678
            3   C1y C    29.0860  -20.5912
            4   C1x C    27.8160  -22.7156
            5   C1z C    25.4051  -21.2700
            6   C1x C    26.6340  -19.1517
            7   C1z C    29.1211  -19.1692
            8   C1x C    26.5989  -23.4002
            9   C1y C    25.3758  -22.6688
            10  C1x C    24.1644  -20.5503
            11  C1a C    25.4109  -19.8363
            12  C1x C    27.8688  -18.4495
            13  C1x C    24.1235  -23.3827
            14  C1x C    22.9121  -21.2466
            15  C5x C    22.9121  -22.6805
            16  O5x O    21.6715  -23.3710
            17  C1x C    31.5101  -20.5811
            18  C1x C    31.4752  -19.2291
            19  C5x C    30.3504  -18.4994
            20  O5x O    30.4044  -17.0802
            21  C1a C    29.1369  -17.7801
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     4   8 1
            8     5   9 1
            9     5  10 1
            10    5  11 1 #Up
            11    6  12 1
            12    9  13 1
            13   10  14 1
            14   13  15 1
            15   15  16 2
            16    7  12 1
            17    8   9 1
            18   14  15 1
            19    3  17 1
            20   17  18 1
            21   18  19 1
            22    7  19 1
            23   19  20 2
            24    7  21 1 #Up

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