KEGG   DRUG: Heptaminol acefyllinate
Entry
D08037                      Drug                                   
Name
Heptaminol acefyllinate;
Cariamyl (TN)
Formula
C17H27N5O4
Exact mass
365.2063
Mol weight
365.4274
Structure
Remark
ATC code: C01DX08
Chemical structure group: DG00236
Efficacy
Vasodilator (coronary)
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01D VASODILATORS USED IN CARDIAC DISEASES
    C01DX Other vasodilators used in cardiac diseases
     C01DX08 Heptaminol
      D08037  Heptaminol acefyllinate
Other DBs
CAS: 5152-72-7
PubChem: 96024730
LigandBox: D08037
LinkDB
KCF data

ATOM        26
            1   C1a C    16.1394  -20.2775
            2   C1c C    17.3324  -19.6459
            3   C1b C    18.5254  -20.2775
            4   C1b C    19.7184  -19.6459
            5   C1b C    20.9114  -20.2775
            6   C1d C    22.1044  -19.6459
            7   N1a N    17.3324  -18.2424
            8   C1a C    21.4026  -18.4529
            9   O7a O    23.3198  -18.9442
            10  C1a C    22.8061  -20.8614
            11  C7a C    24.5183  -19.6363
            12  O6a O    24.5184  -21.0492
            13  C1b C    25.7086  -18.8086
            14  C8y C    28.5606  -16.9793
            15  C8y C    28.5606  -18.3828
            16  C8y C    29.7760  -19.0845
            17  N4y N    30.9916  -18.3828
            18  C8y C    30.9916  -16.9793
            19  N4y N    29.7760  -16.2775
            20  N5x N    27.2257  -16.5456
            21  C8x C    26.4008  -17.6810
            22  N4y N    27.2257  -18.8165
            23  C1a C    29.7760  -14.8742
            24  O5x O    32.2258  -16.2665
            25  O5x O    29.7760  -20.4879
            26  C1a C    32.2258  -19.0956
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     2   7 1
            7     6   8 1
            8     6   9 1
            9     6  10 1
            10    9  11 1
            11   11  12 2
            12   11  13 1
            13   14  15 2
            14   15  16 1
            15   16  17 1
            16   17  18 1
            17   18  19 1
            18   14  19 1
            19   14  20 1
            20   20  21 2
            21   21  22 1
            22   15  22 1
            23   19  23 1
            24   18  24 2
            25   16  25 2
            26   17  26 1
            27   13  22 1

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