KEGG   COMPOUND: C08159Help
Entry
C08159                      Compound                               

Name
Anastrozole
Formula
C17H19N5
Exact mass
293.164
Mol weight
293.3663
Structure
Mol fileKCF fileDB search
Remark
Same as: D00960
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L02 ENDOCRINE THERAPY
   L02B HORMONE ANTAGONISTS AND RELATED AGENTS
    L02BG Aromatase inhibitors
     L02BG03 Anastrozole
      D00960  Anastrozole (JAN/USAN/INN) <JP/US>
USP drug classification [BR:br08302]
 Antineoplastics
  Aromatase Inhibitors, 3rd Generation
   Anastrozole
    D00960  Anastrozole (JAN/USAN/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   429  Miscellaneous
    4291  Other Antitumors
     D00960  Anastrozole (JAN/USAN/INN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Oxidoreductases (EC1)
   Cytochrome P450
    CYP19A1 (ARO)
     D00960  Anastrozole (JAN/USAN/INN) <JP/US>
Antineoplastics [br08340.html]
 D00960
New drug approvals in Japan [br08318.html]
 Drugs with new active ingredients
  D00960
Pharmacogenomic biomarkers [br08341.html]
 Companion diagnostics
  D00960
BRITE hierarchy
Other DBs
CAS: 120511-73-1
PubChem: 10359
ChEBI: 2704
ChEMBL: CHEMBL1399
NIKKAJI: J592.428F
LinkDB All DBs
KCF data Show

ATOM        22
            1   C8x C    22.0500  -14.7700
            2   C8y C    22.0500  -16.1700
            3   C8x C    23.2624  -16.8700
            4   C8y C    24.4749  -16.1700
            5   C8x C    24.4749  -14.7700
            6   C8y C    23.2624  -14.0700
            7   C1b C    23.2624  -12.6702
            8   N4y N    24.4580  -11.9798
            9   C1d C    20.8376  -16.8700
            10  C1d C    25.7060  -16.8810
            11  C3b C    26.9183  -17.5809
            12  C1a C    25.0067  -18.0918
            13  C1a C    26.4068  -15.6674
            14  N3a N    28.1308  -18.2809
            15  C3b C    19.6251  -17.5699
            16  C1a C    20.1434  -15.6673
            17  C1a C    21.5430  -18.0920
            18  N3a N    18.4127  -18.2699
            19  N5x N    25.7879  -12.4172
            20  C8x C    26.6135  -11.2866
            21  N5x N    25.7935  -10.1520
            22  C8x C    24.4609  -10.5813
BOND        23
            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     6   7 1
            8     7   8 1
            9     2   9 1
            10    4  10 1
            11   10  11 1
            12   10  12 1
            13   10  13 1
            14   11  14 3
            15    9  15 1
            16    9  16 1
            17    9  17 1
            18   15  18 3
            19    8  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23    8  22 1

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