KEGG   DRUG: Miproxifene phosphateHelp
Entry
D01853                      Drug                                   

Name
Miproxifene phosphate (JAN);
Tat 59
Formula
C29H36NO5P
Exact mass
509.2331
Mol weight
509.5736
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Other
 DG01619  Clomifene and tamoxifen derivative
  DG01620  Tamoxifene-type antineoplastic
Efficacy
Antineoplastic
Comment
prodrug
Target
NR3A (ESR) [HSA:2099 2100] [KO:K08550 K08551]
  Pathway
hsa04915  Estrogen signaling pathway
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   Estrogen receptor
    NR3A (ESR)
     D01853  Miproxifene phosphate (JAN)
Prodrugs [br08324.html]
 D01853
BRITE hierarchy
Other DBs
CAS: 115767-74-3
PubChem: 7848915
ChEBI: 31855
LigandBox: D01853
NIKKAJI: J410.162F
LinkDB All DBs
KCF data Show

ATOM        36
            1   C8x C    10.1500  -30.5200
            2   C8y C    10.1500  -31.9200
            3   C8x C    11.3624  -32.6200
            4   C8x C    12.5749  -31.9200
            5   C8y C    12.5749  -30.5200
            6   C8x C    11.3624  -29.8200
            7   C8x C    14.9997  -31.9200
            8   C8y C    14.9997  -30.5200
            9   C2c C    13.7873  -29.8200
            10  C8x C    16.2122  -32.6200
            11  C8y C    17.4246  -31.9200
            12  C8x C    17.4246  -30.5200
            13  C8x C    16.2122  -29.8200
            14  O2b O     8.9376  -32.6200
            15  P1b P     7.7421  -31.9296
            16  O1c O     6.5296  -31.2296
            17  O1c O     8.4529  -30.6979
            18  O1c O     7.0535  -33.1227
            19  O2a O    18.6411  -32.6223
            20  C1b C    19.8386  -31.9308
            21  C1b C    21.0249  -32.6157
            22  N1c N    22.2167  -31.9274
            23  C1a C    23.4059  -32.6139
            24  C1a C    22.2167  -30.5203
            25  C2c C    13.7873  -28.4200
            26  C8y C    15.0018  -27.7188
            27  C1b C    12.5769  -27.7212
            28  C1a C    11.3824  -28.4110
            29  C8x C    16.1983  -28.4098
            30  C8x C    17.4108  -27.7099
            31  C8y C    17.4109  -26.3099
            32  C8x C    16.2144  -25.6190
            33  C8x C    15.0019  -26.3188
            34  C1c C    18.6332  -25.6043
            35  C1a C    19.8424  -26.3025
            36  C1a C    18.6331  -24.2201
BOND        38
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    2  14 1
            16   14  15 1
            17   15  16 1
            18   15  17 2
            19   15  18 1
            20   11  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   22  24 1
            26    9  25 2
            27   25  26 1
            28   25  27 1
            29   27  28 1
            30   26  29 2
            31   29  30 1
            32   30  31 2
            33   31  32 1
            34   32  33 2
            35   26  33 1
            36   31  34 1
            37   34  35 1
            38   34  36 1

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