KEGG   DRUG: Pseudoephedrine hydrochlorideHelp
Entry
D00485                      Drug                                   

Name
Pseudoephedrine hydrochloride (USP);
Sudafed (TN)
Product
  Other
Formula
C10H15NO. HCl
Exact mass
201.092
Mol weight
201.6931
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01450  alpha-Adrenergic receptor agonist
   DG01448  alpha1-Adrenergic receptor agonist
   DG01449  alpha2-Adrenergic receptor agonist
  DG01455  beta-Adrenergic receptor agonist
   DG01451  beta1-Adrenergic receptor agonist
   DG01452  beta2-Adrenergic receptor agonist
   DG01453  beta3-Adrenergic receptor agonist
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist
   DG01461  beta1-Adrenergic receptor antagonist
Remark
ATC code: 
Chemical group: 
Efficacy
Vasoconstrictor, Adrenergic receptor agonist
Target
ADRA1 [HSA:148 147 146] [KO:K04135 K04136 K04137];
ADRA2 [HSA:150 151 152] [KO:K04138 K04139 K04140];
ADRB1 [HSA:153] [KO:K04141];
ADRB2 [HSA:154] [KO:K04142];
ADRB3 [HSA:155] [KO:K04143]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Adrenergic signaling in cardiomyocytes
Vascular smooth muscle contraction
Salivary secretion
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R01 NASAL PREPARATIONS
   R01B NASAL DECONGESTANTS FOR SYSTEMIC USE
    R01BA Sympathomimetics
     R01BA02 Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for otolaryngologic use
  69 Oral medicine for nasal inflammation
   D00485  Pseudoephedrine hydrochloride (USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Designated second-class OTC drugs
  Inorganic and organic chemicals
   Pseudoephedrine
    D00485  Pseudoephedrine hydrochloride (USP)
 Second-class OTC drugs
  Inorganic and organic chemicals
   Pseudoephedrine
    D00485  Pseudoephedrine hydrochloride (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    alpha1-adrenergic receptor
     Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
    alpha2-adrenergic receptor
     Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
    beta1-adrenergic receptor
     Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
    beta2-adrenergic receptor
     Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
    beta3-adrenergic receptor
     Pseudoephedrine
      D00485  Pseudoephedrine hydrochloride (USP)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived by amination reactions
   Phenylalanine derived alkaloids
    D00485  Pseudoephedrine hydrochloride (USP)
Rx-to-OTC switch list in the USA [br08315.html]
 D00485
BRITE hierarchy
Other DBs
CAS: 
345-78-8
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        13
            1   X   Cl   31.6713  -29.5074
            2   C8x C    21.1400  -29.6100
            3   C8x C    21.1400  -31.0100
            4   C8x C    22.3524  -31.7100
            5   C8x C    23.5649  -31.0100
            6   C8y C    23.5649  -29.6100
            7   C8x C    22.3524  -28.9100
            8   C1c C    24.7960  -28.8990
            9   C1c C    26.0012  -29.5947
            10  O1a O    24.7957  -27.5101
            11  N1b N    27.1835  -28.9119
            12  C1a C    26.0016  -31.0096
            13  C1a C    28.3775  -29.6012
BOND        12
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     6   8 1
            8     8   9 1
            9     8  10 1 #Down
            10    9  11 1
            11    9  12 1 #Up
            12   11  13 1

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