KEGG   DRUG: Oxogestone phenpropionateHelp
Entry
D05308                      Drug                                   

Name
Oxogestone phenpropionate (USAN)
Formula
C29H38O3
Exact mass
434.2821
Mol weight
434.6102
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Efficacy
Contraceptive
Comment
Progestin
Target
NR3C3 (PGR) [HSA:5241] [KO:K08556]
  Pathway
hsa04114  Oocyte meiosis
hsa04914  Progesterone-mediated oocyte maturation
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C3 (PGR)
     D05308  Oxogestone phenpropionate (USAN)
BRITE hierarchy
Other DBs
CAS: 16915-80-3
PubChem: 47207007
ChEMBL: CHEMBL2107303
LigandBox: D05308
NIKKAJI: J9.060C
LinkDB All DBs
KCF data Show

ATOM        32
            1   C1x C    24.6939  -19.4366
            2   C5x C    24.6939  -20.8348
            3   C2x C    25.9047  -21.5338
            4   C2y C    27.1156  -20.8348
            5   C1y C    27.1156  -19.4366
            6   C1x C    25.9047  -18.7375
            7   C1x C    28.3264  -21.5338
            8   C1x C    29.5372  -20.8348
            9   C1y C    29.5372  -19.4366
            10  C1y C    28.3264  -18.7375
            11  C1y C    30.7481  -18.7375
            12  C1z C    30.7481  -17.3394
            13  C1x C    29.5372  -16.6403
            14  C1x C    28.3264  -17.3394
            15  O5x O    23.4831  -21.5338
            16  C1a C    30.7481  -15.9412
            17  C1x C    33.1730  -18.7375
            18  C1x C    33.1730  -17.3394
            19  C1y C    31.9605  -16.6394
            20  C1c C    31.9605  -15.2394
            21  O7a O    33.1856  -14.5317
            22  C1a C    30.7790  -14.5575
            23  C7a C    34.4061  -15.2357
            24  C1b C    35.6325  -14.5265
            25  O6a O    34.4063  -16.6596
            26  C1b C    36.8579  -15.2325
            27  C8y C    38.0811  -14.5243
            28  C8x C    39.2786  -15.2134
            29  C8x C    40.4900  -14.5116
            30  C8x C    40.4880  -13.1116
            31  C8x C    39.2905  -12.4226
            32  C8x C    38.0791  -13.1243
BOND        36
            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   11  17 1
            20   17  18 1
            21   18  19 1
            22   12  19 1
            23   19  20 1
            24   20  21 1 #Up
            25   20  22 1
            26   21  23 1
            27   23  24 1
            28   23  25 2
            29   24  26 1
            30   26  27 1
            31   27  28 2
            32   28  29 1
            33   29  30 2
            34   30  31 1
            35   31  32 2
            36   27  32 1

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