KEGG   DRUG: XanomelineHelp
Entry
D06330                      Drug                                   

Name
Xanomeline (USAN)
Formula
C14H23N3OS
Exact mass
281.1562
Mol weight
281.4169
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Neuropsychiatric agent
 DG01490  Muscarinic cholinergic receptor agonist
Remark
Same as: 
Chemical group: 
Activity
Alzheimer's disease treatment [cholinergic agent]
Target
muscarinic cholinergic receptor M1 [HSA:1128] [KO:K04129];
muscarinic cholinergic receptor M4 [HSA:1132] [KO:K04132]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Cholinergic synapse
Structure map
Cholinergic and anticholinergic drugs
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    muscarinic cholinergic receptor M1
     Xanomeline
      D06330  Xanomeline (USAN)
    muscarinic cholinergic receptor M4
     Xanomeline
      D06330  Xanomeline (USAN)
BRITE hierarchy
Other DBs
CAS: 
131986-45-3
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        19
            1   N1y N    13.2218  -16.0130
            2   C1x C    13.2218  -17.4120
            3   C1x C    14.4333  -18.1115
            4   C2x C    15.6449  -17.4120
            5   C2y C    15.6449  -16.0130
            6   C1x C    14.4333  -15.3136
            7   C1a C    12.0102  -15.3136
            8   C8y C    16.8751  -15.3026
            9   C8y C    18.0123  -16.1056
            10  N5x N    19.1238  -15.2729
            11  S2x S    18.6753  -13.9585
            12  N5x N    17.2867  -13.9789
            13  O2a O    17.9612  -17.4810
            14  C1b C    19.1587  -18.2331
            15  C1b C    20.3945  -17.5795
            16  C1b C    21.5891  -18.3302
            17  C1b C    22.8504  -17.6636
            18  C1b C    24.0654  -18.4265
            19  C1a C    25.2866  -17.7812
BOND        20
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     5   8 1
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 1
            13    8  12 2
            14    9  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   18  19 1

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