KEGG   COMPOUND: C14634
Entry
C14634                      Compound                               
Name
Methandriol dipropionate
Formula
C26H40O4
Exact mass
416.2927
Mol weight
416.5934
Structure
Remark
Same as: D08197
Brite
Drug groups [BR:br08330]
 Hormonal agent
  DG01590  Androgen receptor agonist
   DG01605  Anabolic steroid
    DG01276  Methandriol
     D08197  Methandriol dipropionate
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C4 (AR)
     D08197  Methandriol dipropionate
Other DBs
CAS: 3593-85-9
PubChem: 17395634
ChEBI: 34835
NIKKAJI: J205.522H
KCF data

ATOM        30
            1   C1x C    21.0972  -20.9992
            2   C1y C    21.0972  -22.3594
            3   C1x C    22.2751  -23.0394
            4   C2y C    23.4530  -22.3594
            5   C1z C    23.4530  -20.9992
            6   C1x C    22.2751  -20.3192
            7   C2x C    24.6309  -23.0394
            8   C1x C    25.8088  -22.3594
            9   C1y C    25.8088  -20.9992
            10  C1y C    24.6309  -20.3192
            11  C1y C    26.9867  -20.3192
            12  C1z C    26.9867  -18.9591
            13  C1x C    25.8088  -18.2791
            14  C1x C    24.6309  -18.9591
            15  C1x C    29.3424  -20.3192
            16  C1x C    29.3424  -18.9591
            17  C1z C    28.1645  -18.2791
            18  C1a C    27.0137  -17.5991
            19  O7a O    28.1697  -16.9190
            20  O7a O    19.8777  -23.0638
            21  C7a C    29.3534  -16.2417
            22  C1a C    23.4500  -19.6000
            23  C1b C    30.5448  -16.9359
            24  C1a C    29.4700  -17.9200
            25  O6a O    29.3590  -14.8403
            26  C1a C    31.7395  -16.2523
            27  C7a C    18.6524  -22.3570
            28  C1b C    17.4283  -23.0648
            29  O6a O    18.6522  -20.9304
            30  C1a C    16.2017  -22.3582
BOND        33
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 2
            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   12  18 1 #Up
            22   17  19 1 #Up
            23    2  20 1 #Up
            24   19  21 1
            25    5  22 1 #Up
            26   21  23 1
            27   17  24 1 #Down
            28   21  25 2
            29   23  26 1
            30   20  27 1
            31   27  28 1
            32   27  29 2
            33   28  30 1

» Japanese version

  All links  
Drug (1)   
   KEGG DRUG (1)   
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (1)   
All databases (4)   

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