KEGG   DRUG: D08384Help
Entry
D08384                      Drug                                   

Name
Pipethanate (INN);
Piperilate
Formula
C21H25NO3
Exact mass
339.1834
Mol weight
339.4281
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antispasmodic
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
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor
     Pipethanate
      D08384  Pipethanate (INN)
BRITE hierarchy
Other DBs
CAS: 
4546-39-8
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   C1x C    19.3200  -18.6200
            2   N1y N    20.5100  -19.3200
            3   C1b C    21.7700  -18.6200
            4   C1b C    22.9600  -19.3200
            5   O7a O    24.1500  -18.6200
            6   C7a C    25.4100  -19.3200
            7   C1d C    26.6000  -18.6200
            8   C8y C    27.7900  -19.3200
            9   C8x C    28.9800  -18.6200
            10  C1x C    18.1300  -19.3200
            11  C1x C    18.1300  -20.7200
            12  C1x C    19.3200  -21.4200
            13  C1x C    20.5100  -20.7200
            14  C8y C    26.6000  -17.2200
            15  C8x C    27.7900  -16.5200
            16  C8x C    27.7900  -15.1200
            17  C8x C    26.6000  -14.4200
            18  C8x C    25.4100  -15.1200
            19  C8x C    25.4100  -16.5200
            20  C8x C    27.7900  -20.7200
            21  C8x C    28.9800  -21.4200
            22  C8x C    30.2400  -20.7200
            23  C8x C    30.2400  -19.3200
            24  O1a O    27.7900  -17.9200
            25  O6a O    25.4100  -20.7200
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     1  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13   13   2 1
            14    7  14 1
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   14  19 2
            21    8  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23   9 2
            26    7  24 1
            27    6  25 2

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