KEGG   DRUG: D00723Help
Entry
D00723                      Drug                                   

Name
Tridihexethyl chloride (BAN);
Pathilon (TN)
Formula
C21H36NO. Cl
Exact mass
353.2485
Mol weight
353.9696
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
anticholinergic, antimuscarinic
Remark
ATC code: 
Target
muscarinic cholinergic receptor antagonist [HSA:1128 1129 1131 1132 1133] [KO:K04129 K04130 K04131 K04132 K04133]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse
hsa04970  Salivary secretion
hsa04971  Gastric acid secretion  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
   A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
    A03AB Synthetic anticholinergics, quaternary ammonium compounds
     A03AB08 Tridihexethyl
      D00723  Tridihexethyl chloride (BAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor [HSA:1128 1129 1131 1132 1133] [KO:K04129 K04130 K04131 K04132 K04133]
     Tridihexethyl [ATC:A03AB08]
      D00723  Tridihexethyl chloride (BAN)
BRITE hierarchy
Other DBs
CAS: 
4310-35-4
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   X   Cl   14.6362   -9.4591 #-
            2   C1a C    10.9813   -8.1054
            3   C1b C    12.1927   -7.4059
            4   N1d N    13.4043   -8.1054 #+
            5   C1b C    14.6157   -7.4059
            6   C1b C    15.8272   -8.1054
            7   C1d C    17.0387   -7.4059
            8   C8y C    18.2502   -8.1054
            9   C8x C    19.4617   -7.4059
            10  C8x C    20.6732   -8.1054
            11  C8x C    18.2502   -9.5043
            12  C8x C    19.4617  -10.2037
            13  C8x C    20.6732   -9.5043
            14  C1y C    17.0387   -6.0073
            15  C1x C    18.2710   -5.2956
            16  C1x C    18.2708   -3.8967
            17  C1x C    17.0591   -3.1974
            18  C1x C    15.8269   -3.9092
            19  C1x C    15.8271   -5.3081
            20  O1a O    18.2502   -6.7065
            21  C1b C    13.4043   -9.5043
            22  C1a C    12.2117  -10.1930
            23  C1b C    13.4043   -6.7065
            24  C1a C    12.4151   -5.7173
BOND        24
            1     2   3 1
            2     3   4 1
            3     4   5 1
            4     5   6 1
            5     6   7 1
            6     7   8 1
            7     8   9 1
            8     9  10 2
            9     8  11 2
            10   11  12 1
            11   12  13 2
            12   13  10 1
            13    7  14 1
            14   14  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 1
            19   14  19 1
            20    7  20 1
            21    4  21 1
            22   21  22 1
            23    4  23 1
            24   23  24 1

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