KEGG   DRUG: Acetylcholine chlorideHelp
Entry
D00999                      Drug                                   

Name
Acetylcholine chloride (JP17/USP/INN);
Miochol (TN)
Product
Formula
C7H16NO2. Cl
Exact mass
181.087
Mol weight
181.6604
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01532  Nicotinic cholinergic receptor agonist
Neuropsychiatric agent
 DG01490  Muscarinic cholinergic receptor agonist
Other
 DG01570  Nicotinic cholinergic receptor agonist
Metabolizing enzyme substrate
 DG02974  ACHE substrate
Remark
Same as: C08201
Therapeutic category: 1232 7222
ATC code: S01EB09
Chemical structure group: DG01133
Product (DG01133): D00999<JP/US>
Efficacy
Miotic, Vasodilator (peripheral), Cholinergic receptor agonist
Comment
Quaternary ammonium compound
Target
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04970  Salivary secretion
hsa04971  Gastric acid secretion
Metabolism
Enzyme: ACHE [HSA:43]
Interaction
Drug interaction
Structure map
map07220  Cholinergic and anticholinergic drugs
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EB Parasympathomimetics
     S01EB09 Acetylcholine
      D00999  Acetylcholine chloride (JP17/USP/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  12  Agents affecting peripheral nervous system
   123  Autonomic nervous system agents
    1232  Acetylcholines
     D00999  Acetylcholine chloride (JP17/USP/INN)
 7  Agents not mainly for therapeutic purpose
  72  Intracorporeal diagnostic agents
   722  Various function testing reagents
    7222  Diagnostic reagents for circulatory function
     D00999  Acetylcholine chloride (JP17/USP/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM
     D00999  Acetylcholine chloride (JP17/USP/INN) <JP/US>
 Ion channels
  Ligand-gated ion channels
   Acetylcholine (nicotinic)
    CHRN
     D00999  Acetylcholine chloride (JP17/USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00999  Acetylcholine chloride for injection
BRITE hierarchy
Other DBs
CAS: 60-31-1
PubChem: 7848062
ChEBI: 2417
ChEMBL: CHEMBL1184
LigandBox: D00999
NIKKAJI: J231.275A
KCF data Show

ATOM        11
            1   N1d N    17.4483  -17.4183 #+
            2   C1b C    18.5738  -18.0657
            3   C1a C    16.6728  -15.9663
            4   C1a C    15.9437  -17.4126
            5   C1a C    16.6728  -18.8646
            6   C1b C    19.7051  -17.4183
            7   O7a O    20.8363  -18.0657
            8   C7a C    21.9677  -17.4183
            9   C1a C    23.0874  -18.0657
            10  O6a O    21.9677  -16.1121
            11  X   Cl   26.5628  -17.6982 #-
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     8  10 2

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