KEGG   DRUG: EthylmorphineHelp
Entry
D07929                      Drug                                   

Name
Ethylmorphine (BAN)
Formula
C19H23NO3
Exact mass
313.1678
Mol weight
313.3908
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01564  Opioid receptor agonist
  DG01563  mu-Opioid receptor agonist
Cyp substrate
 DG01633  CYP3A substrate
Remark
Same as: 
ATC code: 
Chemical group: 
Activity
Analgesic (narcotic), Antitussive, Opioid receptor agonist
Comment
Opium alkaloid
Target
OPRM1 [HSA:4988] [KO:K04215]
  Pathway
Neuroactive ligand-receptor interaction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 R RESPIRATORY SYSTEM
  R05 COUGH AND COLD PREPARATIONS
   R05D COUGH SUPPRESSANTS, EXCL. COMBINATIONS WITH EXPECTORANTS
    R05DA Opium alkaloids and derivatives
     R05DA01 Ethylmorphine
      D07929  Ethylmorphine (BAN)
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01X OTHER OPHTHALMOLOGICALS
    S01XA Other ophthalmologicals
     S01XA06 Ethylmorphine
      D07929  Ethylmorphine (BAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    mu-opioid receptor
     Ethylmorphine
      D07929  Ethylmorphine (BAN)
Phytochemicals used as drugs [BR:br08306]
 Alkaloids
  Alkaloids derived from tyrosine
   Isoquinoline alkaloids
    D07929  Ethylmorphine (BAN)
BRITE hierarchy
Other DBs
CAS: 
76-58-4
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        23
            1   C1z C    24.0800  -18.6200
            2   C8y C    24.0800  -17.2900
            3   C1y C    25.2000  -19.3200
            4   C1y C    22.9600  -19.2500
            5   C1x C    25.2000  -17.9900
            6   C8y C    22.9600  -16.6600
            7   C8y C    25.2000  -16.6600
            8   C1y C    26.3200  -18.6200
            9   C2x C    25.2000  -20.5800
            10  O2x O    21.6300  -17.9200
            11  C1y C    22.9600  -20.5800
            12  C1x C    27.4400  -17.9900
            13  C8y C    22.9600  -15.3300
            14  C1x C    26.3200  -17.3600
            15  C8x C    25.2000  -15.3300
            16  N1y N    27.4400  -19.3200
            17  C2x C    24.0800  -21.2800
            18  O1a O    21.8400  -21.2800
            19  C8x C    24.1500  -14.7000
            20  O2a O    21.8400  -14.7000
            21  C1b C    20.6500  -15.3300
            22  C1a C    28.8400  -19.3200
            23  C1a C    19.4600  -14.6300
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 2
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1 #Down
            10    4  11 1
            11    5  12 1
            12    6  13 1
            13    7  14 1
            14    7  15 2
            15    8  16 1 #Up
            16    9  17 2
            17   11  18 1 #Down
            18   13  19 2
            19   13  20 1
            20   20  21 1
            21    6  10 1
            22    8  14 1
            23   11  17 1
            24   12  16 1
            25   15  19 1
            26   16  22 1
            27   21  23 1

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