KEGG   COMPOUND: C11767Help
Entry
C11767                      Compound                               

Name
Xanomeline
Formula
C14H23N3OS
Exact mass
281.1562
Mol weight
281.4169
Structure
Mol fileKCF fileDB search
Remark
Same as: D06330
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Acetylcholine (muscarinic)
    CHRM1
     D06330  Xanomeline (USAN)
    CHRM4
     D06330  Xanomeline (USAN)
BRITE hierarchy
Other DBs
CAS: 131986-45-3
PubChem: 13931
ChEBI: 10056
ChEMBL: CHEMBL21536
NIKKAJI: J489.337I
KCF data Show

ATOM        19
            1   N1y N    13.1822  -15.9880
            2   C1x C    13.1822  -17.3963
            3   C1x C    14.3793  -18.1004
            4   C2x C    15.5763  -17.3963
            5   C2y C    15.5763  -15.9880
            6   C1x C    14.3793  -15.2839
            7   C1a C    11.9852  -15.2839
            8   C8y C    16.8437  -15.2839
            9   C8y C    17.9704  -16.0584
            10  N5x N    19.0970  -15.2135
            11  S2x S    18.6745  -13.9460
            12  N5x N    17.2662  -13.9460
            13  O2a O    17.9704  -17.4667
            14  C1b C    19.1674  -18.1709
            15  C1b C    20.3644  -17.5371
            16  C1b C    21.5615  -18.3117
            17  C1b C    22.8289  -17.6075
            18  C1b C    24.0964  -18.3821
            19  C1a C    25.2934  -17.7484
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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