KEGG   DRUG: XylometazolineHelp
Entry
D08684                      Drug                                   

Name
Xylometazoline (INN);
Balminil (TN)
Formula
C16H24N2
Exact mass
244.1939
Mol weight
244.3752
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01450  alpha-Adrenergic receptor agonist
   DG01448  alpha1-Adrenergic receptor agonist
    DG01654  alpha1-Adrenergic receptor specific agonist
Remark
Same as: 
ATC code: 
Chemical group: 
Activity
Vasoconstrictor, alpha1-Adrenergic receptor agonist
Comment
Imidazoline derivative
Target
ADRA1 [HSA:148 147 146] [KO:K04135 K04136 K04137]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Vascular smooth muscle contraction
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01A DECONGESTANTS AND OTHER NASAL PREPARATIONS FOR TOPICAL USE
    R01AA Sympathomimetics, plain
     R01AA07 Xylometazoline
      D08684  Xylometazoline (INN)
    R01AB Sympathomimetics, combinations excl. corticosteroids
     R01AB06 Xylometazoline
      D08684  Xylometazoline (INN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01G DECONGESTANTS AND ANTIALLERGICS
    S01GA Sympathomimetics used as decongestants
     S01GA03 Xylometazoline
      D08684  Xylometazoline (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha1-adrenergic receptor
     Xylometazoline
      D08684  Xylometazoline (INN)
BRITE hierarchy
Other DBs
CAS: 
526-36-3
PubChem: 
ChEBI: 
ChEMBL: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        18
            1   C8y C    19.3200  -16.5900
            2   C8x C    19.3200  -17.9900
            3   C8y C    20.5100  -18.6900
            4   C8x C    21.7700  -17.9900
            5   C8y C    21.7700  -16.5900
            6   C8y C    20.5100  -15.8900
            7   C1b C    20.5100  -14.4900
            8   C2y C    21.7000  -13.7900
            9   N1x N    23.0300  -14.2100
            10  C1x C    23.8700  -13.0900
            11  C1x C    23.0300  -11.9700
            12  N2x N    21.7000  -12.4600
            13  C1a C    22.9600  -15.8900
            14  C1d C    20.5100  -20.0900
            15  C1a C    18.1300  -15.8900
            16  C1a C    21.9100  -20.0900
            17  C1a C    19.1100  -20.0900
            18  C1a C    20.5100  -21.4900
BOND        19
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13    8  12 2
            14    5  13 1
            15    3  14 1
            16    1  15 1
            17   14  16 1
            18   14  17 1
            19   14  18 1

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