KEGG   COMPOUND: C11775
Entry
C11775                      Compound                               
Name
Xamoterol
Formula
C16H25N3O5
Exact mass
339.1794
Mol weight
339.3868
Structure
Remark
Same as: D06328
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
    C01CX Other cardiac stimulants
     C01CX07 Xamoterol
      D06328  Xamoterol (USAN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01703  Cardiotonic
   DG00231  Xamoterol
    D06328  Xamoterol
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB1
     D06328  Xamoterol (USAN)
Other DBs
CAS: 81801-12-9
PubChem: 13939
ChEBI: 10055
NIKKAJI: J260.445K
LinkDB
KCF data

ATOM        24
            1   O2a O    23.1977  -17.0849
            2   C1b C    24.4097  -16.3867
            3   C1c C    25.6203  -17.0873
            4   C1b C    26.8324  -16.3893
            5   N1b N    28.0429  -17.0898
            6   C1b C    29.2549  -16.3916
            7   C1b C    30.4654  -17.0923
            8   O1a O    25.6188  -18.4859
            9   N1b N    31.6750  -16.3933
            10  C5a C    32.8881  -17.0949
            11  N1y N    34.1164  -16.3870
            12  O5a O    32.8871  -18.4799
            13  C1x C    35.3054  -17.0749
            14  C1x C    36.5185  -16.3759
            15  O2x O    36.5197  -14.9759
            16  C1x C    35.3308  -14.2881
            17  C1x C    34.1177  -14.9870
            18  C8y C    21.9632  -16.3703
            19  C8x C    21.9649  -14.9801
            20  C8x C    20.7533  -14.2786
            21  C8y C    19.5400  -14.9772
            22  C8x C    19.5383  -16.3674
            23  C8x C    20.7499  -17.0689
            24  O1a O    18.3222  -14.2720
BOND        25
            1     5   6 1
            2     6   7 1
            3     7   9 1
            4     8   3 1
            5     1   2 1
            6     9  10 1
            7     2   3 1
            8     3   4 1
            9     4   5 1
            10   10  11 1
            11   10  12 2
            12   11  13 1
            13   13  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   11  17 1
            18    1  18 1
            19   18  19 2
            20   19  20 1
            21   20  21 2
            22   21  22 1
            23   22  23 2
            24   18  23 1
            25   21  24 1

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