KEGG   DRUG: Benzethidine
Entry
D12685                      Drug                                   
Name
Benzethidine (INN)
Formula
C23H29NO3
Exact mass
367.2147
Mol weight
367.48
Structure
Class
Neuropsychiatric agent
 DG01564  Opioid receptor agonist
  DG01563  mu-Opioid receptor agonist
Analgesic
 DG01984  Opioid analgesics
Efficacy
Analgesic (narcotic), Opioid receptor agonist
Comment
Phenylpiperidine derivative
Target
OPRM1 [HSA:4988] [KO:K04215]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa05032  Morphine addiction
Interaction
Brite
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01564  Opioid receptor agonist
   DG01563  mu-Opioid receptor agonist
    D12685  Benzethidine
 Analgesic
  DG01984  Opioid analgesics
   D12685  Benzethidine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D12685  Benzethidine (INN)
Narcotics and psychotropics in Japan [br08308.html]
 Narcotics by Control Act Article 2 Table 1 (76 substances)
  D12685
Other DBs
CAS: 3691-78-9
PubChem: 497621098
LinkDB
KCF data

ATOM        27
            1   C8x C    23.2661  -13.1748
            2   C8y C    23.2661  -14.5063
            3   C8x C    24.4575  -15.2071
            4   C8x C    25.6488  -14.5063
            5   C8x C    25.6488  -13.1748
            6   C8x C    24.4575  -12.4740
            7   C1z C    22.0047  -15.2071
            8   C1x C    20.8134  -14.5764
            9   C1x C    19.5520  -15.2772
            10  N1y N    19.5520  -16.6787
            11  C1x C    20.8134  -17.3094
            12  C1x C    22.0047  -16.6087
            13  C1b C    18.3606  -17.3795
            14  C7a C    22.7055  -16.4685
            15  O7a O    24.1771  -16.4685
            16  O6a O    22.0047  -17.6598
            17  C1b C    24.8079  -17.6598
            18  C1a C    26.2795  -17.6598
            19  C1b C    17.1693  -16.6787
            20  O2a O    15.9079  -17.3795
            21  C1b C    14.7165  -16.6787
            22  C8y C    13.4551  -17.4496
            23  C8x C    12.2057  -16.7694
            24  C8x C    12.2957  -19.5793
            25  C8x C    13.4590  -18.7930
            26  C8x C    10.9932  -17.4694
            27  C8x C    10.9932  -18.8694
BOND        29
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     2   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13    7  12 1
            14   10  13 1
            15    7  14 1
            16   14  15 1
            17   14  16 2
            18   15  17 1
            19   17  18 1
            20   13  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 2
            25   24  25 2
            26   22  25 1
            27   23  26 1
            28   26  27 2
            29   27  24 1

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