KEGG   DRUG: Oxetorone fumarate
Entry
D05290                      Drug                                   
Name
Oxetorone fumarate (USAN)
Formula
C21H21NO2. C4H4O4
Exact mass
435.1682
Mol weight
435.47
Structure
Remark
ATC code: N02CX06
Chemical structure group: DG00844
Efficacy
Analgesic, Antimigraine
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02C ANTIMIGRAINE PREPARATIONS
    N02CX Other antimigraine preparations
     N02CX06 Oxetorone
      D05290  Oxetorone fumarate (USAN)
Other DBs
CAS: 34522-46-8
PubChem: 47206993
LigandBox: D05290
NIKKAJI: J244.515H
LinkDB
KCF data

ATOM        32
            1   C8y C    29.7254  -19.1803
            2   O2x O    28.8617  -20.2818
            3   C1x C    27.4576  -20.3022
            4   C8y C    26.5740  -19.2240
            5   C8y C    29.3913  -17.8077
            6   C8y C    26.8592  -17.8468
            7   C2y C    28.1164  -17.2192
            8   C8x C    31.0725  -19.5749
            9   C8x C    32.0878  -18.6054
            10  C8x C    31.7537  -17.2328
            11  C8x C    30.4066  -16.8382
            12  C2b C    28.1643  -15.7944
            13  C1b C    29.3877  -15.1419
            14  C1b C    30.6007  -15.8977
            15  N1c N    31.8233  -15.2461
            16  C1a C    32.9851  -15.9705
            17  C1a C    31.8715  -13.8297
            18  O2x O    25.6374  -17.1501
            19  C8y C    24.5973  -18.0967
            20  C8y C    25.1761  -19.2381
            21  C8x C    23.1938  -18.0967
            22  C8x C    22.4792  -19.3352
            23  C8x C    23.1616  -20.5162
            24  C8x C    24.5639  -20.5156
            25  C6a C    36.7547  -17.4072
            26  C2b C    37.9690  -18.1112
            27  O6a O    35.5404  -18.1112
            28  O6a O    36.7547  -16.0054
            29  C2b C    39.1890  -17.4072
            30  C6a C    40.4032  -18.1112
            31  O6a O    41.6176  -17.4072
            32  O6a O    40.4032  -19.5130
BOND        34
            1     3   4 1
            2     1   5 1
            3     2   3 1
            4     5   7 1
            5     1   2 1
            6     6   7 1
            7     1   8 2
            8     8   9 1
            9     9  10 2
            10   10  11 1
            11    5  11 2
            12    7  12 2
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   15  17 1
            18    4   6 2
            19    6  18 1
            20   18  19 1
            21   19  20 1
            22    4  20 1
            23   19  21 2
            24   21  22 1
            25   22  23 2
            26   23  24 1
            27   24  20 2
            28   25  26 1
            29   25  27 1
            30   25  28 2
            31   26  29 2
            32   29  30 1
            33   30  31 1
            34   30  32 2

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