KEGG   COMPOUND: C08164Help
Entry
C08164                      Compound                               

Name
Nilutamide
Formula
C12H10F3N3O4
Exact mass
317.0623
Mol weight
317.2207
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L02 ENDOCRINE THERAPY
   L02B HORMONE ANTAGONISTS AND RELATED AGENTS
    L02BB Anti-androgens
     L02BB02 Nilutamide
      D00965  Nilutamide (USAN/INN)
USP drug classification [BR:br08302]
 Antineoplastics
  Antiandrogens
   Nilutamide
    D00965  Nilutamide (USAN/INN)
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    androgen receptor
     Nilutamide
      D00965  Nilutamide (USAN/INN)
Cytochrome P450 interactions [BR:br08309]
 CYP substrates
  CYP2C19
   Nilutamide
    D00965  Nilutamide (USAN/INN)
Antineoplastics [br08340.html]
 D00965
BRITE hierarchy
Other DBs
CAS: 
63612-50-0
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   N1y N    34.9289  -18.7594
            2   C8y C    36.1189  -19.4594
            3   C5x C    33.7389  -19.5294
            4   C5x C    34.5789  -17.3595
            5   C8x C    36.1189  -20.8594
            6   C8x C    37.3788  -18.7594
            7   C1z C    32.6890  -18.6194
            8   O5x O    33.7389  -20.9294
            9   N1x N    33.1790  -17.3595
            10  O5x O    35.5589  -16.3795
            11  C8x C    37.3788  -21.5594
            12  C8y C    38.5688  -19.4594
            13  C1a C    31.7090  -17.6395
            14  C1a C    31.4990  -19.3194
            15  C8y C    38.5688  -20.8594
            16  N2b N    39.7588  -21.5594 #+
            17  O3a O    39.7588  -22.9593
            18  O3a O    41.0187  -20.8594 #-
            19  C1d C    39.7841  -18.7643
            20  X   F    40.9964  -18.0644
            21  X   F    39.0841  -17.5520
            22  X   F    40.4840  -19.9768
BOND        23
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 2
            10    5  11 1
            11    6  12 2
            12    7  13 1
            13    7  14 1
            14   11  15 2
            15   15  16 1
            16   16  17 2
            17   16  18 1
            18    7   9 1
            19   12  15 1
            20   12  19 1
            21   19  20 1
            22   19  21 1
            23   19  22 1

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