KEGG   COMPOUND: C04227Help
Entry
C04227                      Compound                               

Name
Octopamine;
1-(4-Hydroxyphenyl)-2-aminoethanol;
p-Hydroxyphenylethanolamine
Formula
C8H11NO2
Exact mass
153.079
Mol weight
153.1784
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
ATC code: 
Drug group: 
Reaction
Pathway
Neuroactive ligand-receptor interaction
Enzyme
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C01 CARDIAC THERAPY
   C01C CARDIAC STIMULANTS EXCL. CARDIAC GLYCOSIDES
    C01CA Adrenergic and dopaminergic agents
     C01CA18 Octopamine
      C04227  1-(4-Hydroxyphenyl)-2-aminoethanol
BRITE hierarchy
Other DBs
CAS: 
104-14-3
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
NIKKAJI: 
KCF data Show

ATOM        11
            1   C8y C    26.4600  -16.0300
            2   C8x C    26.4600  -17.4300
            3   C8x C    25.2700  -15.3300
            4   C1c C    27.6500  -15.3300
            5   C8x C    25.2700  -18.1300
            6   C8x C    24.0800  -16.0300
            7   C1b C    28.9100  -16.0300
            8   O1a O    27.6500  -13.9300
            9   C8y C    24.0800  -17.4300
            10  N1a N    30.1000  -15.3300
            11  O1a O    22.8200  -18.1300
BOND        11
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 1 #Up
            8     5   9 2
            9     7  10 1
            10    9  11 1
            11    6   9 1

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