KEGG   DRUG: Pentoxyverine hydrochloride
Entry
D08335                      Drug                                   
Name
Pentoxyverine hydrochloride;
Sedotussin (TN);
Toclase (TN)
Formula
C20H31NO3. HCl
Exact mass
369.2071
Mol weight
369.92
Structure
Simcomp
Remark
ATC code: R05DB05
Chemical structure group: DG01084
Product (DG01084): D01260<JP>
Efficacy
Antitussive
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R05 COUGH AND COLD PREPARATIONS
   R05D COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
    R05DB Other cough suppressants
     R05DB05 Pentoxyverine
      D08335  Pentoxyverine hydrochloride
Other DBs
CAS: 1045-21-2
PubChem: 96025022
LigandBox: D08335
LinkDB
KCF data

ATOM        25
            1   C8x C    19.3200  -16.3100
            2   C8y C    19.9500  -17.5000
            3   C8x C    21.3500  -17.5000
            4   C8x C    22.0500  -16.3100
            5   C8x C    21.3500  -15.1200
            6   C8x C    19.9500  -15.1200
            7   C1z C    19.3200  -18.7600
            8   C7a C    20.4400  -19.4600
            9   O7a O    21.7000  -18.7600
            10  C1b C    22.8900  -19.4600
            11  C1b C    24.0800  -18.7600
            12  O2a O    25.2700  -19.4600
            13  C1b C    26.5300  -18.7600
            14  C1b C    27.7200  -19.4600
            15  N1c N    28.9100  -18.7600
            16  C1b C    30.1700  -19.4600
            17  C1a C    31.3600  -18.7600
            18  C1x C    18.9000  -20.0200
            19  C1x C    18.2000  -17.9200
            20  C1x C    17.0100  -18.7600
            21  C1x C    17.5000  -20.0200
            22  O6a O    20.4400  -20.7900
            23  C1b C    28.9100  -17.3600
            24  C1a C    30.1700  -16.6600
            25  X   Cl   36.1200  -18.2000
BOND        25
            1     1   2 2
            2     8   9 1
            3     2   3 1
            4    18   7 1
            5     7  19 1
            6    19  20 1
            7    20  21 1
            8    21  18 1
            9     9  10 1
            10    8  22 2
            11    3   4 2
            12   15  23 1
            13   10  11 1
            14   23  24 1
            15    4   5 1
            16   11  12 1
            17    5   6 2
            18   12  13 1
            19    6   1 1
            20   13  14 1
            21   14  15 1
            22    2   7 1
            23   15  16 1
            24   16  17 1
            25    7   8 1

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