KEGG   DRUG: Oxabolone cipionateHelp
Entry
D01149                      Drug                                   

Name
Oxabolone cipionate (JAN/INN)
Formula
C26H38O4
Exact mass
414.277
Mol weight
414.5775
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Other
 DG01590  Androgen receptor agonist
  DG01605  Anabolic steroid
Remark
ATC code: 
Activity
Anabolic, Androgen receptor agonist
Comment
Estren derivative
Target
NR3C4 (AR) [HSA:367] [KO:K08557]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A14 ANABOLIC AGENTS FOR SYSTEMIC USE
   A14A ANABOLIC STEROIDS
    A14AB Estren derivatives
     A14AB03 Oxabolone cipionate
      D01149  Oxabolone cipionate (JAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    androgen receptor
     Oxabolone cipionate
      D01149  Oxabolone cipionate (JAN/INN)
BRITE hierarchy
Other DBs
CAS: 
1254-35-9
PubChem: 
ChEBI: 
ChEMBL: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        30
            1   C1x C    32.3021  -15.6532
            2   C1x C    32.7302  -14.3459
            3   C1x C    31.6144  -13.5345
            4   C1y C    30.4988  -14.3459
            5   C1x C    30.9267  -15.6532
            6   C1x C    18.5631  -18.3678
            7   C5x C    18.5631  -19.7432
            8   C2y C    19.7571  -20.4308
            9   C1x C    19.7571  -17.6801
            10  C1y C    20.9441  -18.3678
            11  C2y C    20.9382  -19.7432
            12  C1x C    22.1264  -20.4358
            13  C1x C    23.3204  -19.7533
            14  C1y C    22.1382  -17.6853
            15  C1y C    23.3205  -18.3808
            16  C1x C    23.3430  -15.6374
            17  C1x C    22.1494  -16.3134
            18  C1z C    24.5254  -16.3329
            19  C1y C    24.5089  -17.7004
            20  C1x C    26.8775  -17.7293
            21  C1x C    26.8942  -16.3616
            22  C1y C    25.7180  -15.6636
            23  O7a O    25.7347  -14.2882
            24  C7a C    26.9340  -13.6150
            25  O6a O    26.9507  -12.2398
            26  C1b C    28.1167  -14.3170
            27  C1b C    29.3160  -13.6439
            28  C1a C    24.5162  -14.9572
            29  O1a O    19.7604  -21.8062
            30  O5x O    17.3725  -20.4315
BOND        34
            1    15  19 1
            2    18  16 1
            3    16  17 1
            4    17  14 1
            5     8  11 2
            6    10   9 1
            7     9   6 1
            8     4   5 1
            9     5   1 1
            10   18  19 1
            11   20  21 1
            12   21  22 1
            13   22  18 1
            14   19  20 1
            15   22  23 1 #Up
            16    1   2 1
            17   23  24 1
            18   10  11 1
            19   24  25 2
            20   11  12 1
            21   24  26 1
            22   12  13 1
            23   26  27 1
            24   27   4 1
            25   13  15 1
            26   18  28 1 #Up
            27   14  10 1
            28    2   3 1
            29    8  29 1
            30    3   4 1
            31    7  30 2
            32    6   7 1
            33    7   8 1
            34   14  15 1

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