KEGG   COMPOUND: C07913
Entry
C07913                      Compound                               
Name
Xylometazoline
Formula
C16H24N2
Exact mass
244.1939
Mol weight
244.3752
Structure
Remark
Same as: D08684
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
    ADRA1
     D08684  Xylometazoline (INN)
    ADRA2
     D08684  Xylometazoline (INN)
Other DBs
CAS: 526-36-3
PubChem: 10115
ChEBI: 10082
NIKKAJI: J6.660E
KCF data

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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