KEGG   DRUG: D03454Help
Entry
D03454                      Drug                                   

Name
Cetrimonium bromide (NF/INN)
Formula
C19H42N. Br
Exact mass
363.2501
Mol weight
364.4475
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
ATC code: 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D08 ANTISEPTICS AND DISINFECTANTS
   D08A ANTISEPTICS AND DISINFECTANTS
    D08AJ Quaternary ammonium compounds
     D08AJ02 Cetrimonium
      D03454  Cetrimonium bromide (NF/INN)
 R RESPIRATORY SYSTEM
  R02 THROAT PREPARATIONS
   R02A THROAT PREPARATIONS
    R02AA Antiseptics
     R02AA17 Cetrimonium
      D03454  Cetrimonium bromide (NF/INN)
BRITE hierarchy
Other DBs
CAS: 
57-09-0
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        21
            1   N1d N    16.9400  -10.8500 #+
            2   C1b C    18.2000  -10.1500
            3   C1b C    19.3900  -10.8500
            4   C1b C    20.5800  -10.1500
            5   C1b C    21.7700  -10.8500
            6   C1b C    23.0300  -10.1500
            7   C1b C    24.2200  -10.8500
            8   C1b C    25.4100  -10.1500
            9   C1b C    26.6700  -10.8500
            10  C1b C    27.8600  -10.1500
            11  C1b C    29.0500  -10.8500
            12  C1b C    30.2400  -10.1500
            13  C1b C    31.5000  -10.8500
            14  C1b C    32.6900  -10.0800
            15  C1b C    33.8800  -10.7800
            16  C1b C    35.1400  -10.0800
            17  C1a C    36.3300  -10.7800
            18  C1a C    15.7500  -11.5500
            19  C1a C    16.2400   -9.6600
            20  C1a C    17.6400  -12.0400
            21  X   Br   17.0800   -8.1900 #-
BOND        19
            1     4   5 1
            2    10  11 1
            3    11  12 1
            4     5   6 1
            5    12  13 1
            6     2   3 1
            7    13  14 1
            8     6   7 1
            9    14  15 1
            10   15  16 1
            11    7   8 1
            12   16  17 1
            13    3   4 1
            14    8   9 1
            15    1   2 1
            16    9  10 1
            17    1  18 1
            18    1  19 1
            19    1  20 1

» Japanese version   » Back

DBGET integrated database retrieval system