KEGG   DRUG: Acetorphine
Entry
D12700                      Drug                                   
Name
Acetorphine (INN)
Formula
C27H35NO5
Exact mass
453.2515
Mol weight
453.57
Structure
Class
Neuropsychiatric agent
 DG01564  Opioid receptor agonist
Analgesic
 DG01984  Opioid analgesics
Efficacy
Analgesic (veterinary), Anesthetic (veterinary), Opioid receptor agonist
Target
OPRM1 [HSA:4988] [KO:K04215]
OPRK1 [HSA:4986] [KO:K04214]
OPRD1 [HSA:4985] [KO:K04213]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Brite
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01564  Opioid receptor agonist
   D12700  Acetorphine
 Analgesic
  DG01984  Opioid analgesics
   D12700  Acetorphine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D12700  Acetorphine (INN)
    OPRK1
     D12700  Acetorphine (INN)
    OPRD1
     D12700  Acetorphine (INN)
Narcotics and psychotropics in Japan [br08308.html]
 Narcotics by Cabinet Order Article 1 (157 substances)
  D12700
Other DBs
CAS: 25333-77-1
PubChem: 497621113
LinkDB
KCF data

ATOM        33
            1   C1z C    18.1354  -15.6243
            2   C1z C    19.3211  -16.3218
            3   C1y C    16.9496  -16.3218
            4   C8y C    18.1354  -14.2991
            5   C1x C    19.3211  -14.9268
            6   C1y C    20.5069  -15.6941
            7   C1x C    19.3211  -17.7169
            8   C2x C    18.7631  -17.3681
            9   C1z C    16.9496  -17.6471
            10  O2x O    16.2521  -14.7873
            11  C8y C    16.9496  -13.6016
            12  C8y C    19.3211  -13.6016
            13  C1x C    21.6926  -14.9268
            14  N1y N    21.6926  -16.3218
            15  C1x C    20.5069  -14.2991
            16  C1y C    18.1354  -18.3446
            17  C2x C    17.5773  -16.6706
            18  O2a O    15.5546  -17.6471
            19  C8y C    16.9496  -12.2066
            20  C8x C    19.3211  -12.2066
            21  C1a C    22.8086  -15.6941
            22  C1d C    18.1354  -19.7396
            23  C1a C    14.4386  -18.6236
            24  C8x C    18.2051  -11.5091
            25  O7a O    15.7638  -11.5091
            26  C1b C    19.2514  -20.4371
            27  O1a O    16.8798  -20.3674
            28  C1a C    16.8798  -19.0421
            29  C1b C    20.4371  -19.7396
            30  C1a C    21.6229  -20.4371
            31  C7a C    14.5514  -12.2091
            32  C1a C    13.3390  -11.5091
            33  O6a O    14.5514  -13.6091
BOND        38
            1     1   3 1
            2     1   4 1
            3     1   5 1 #Up
            4     2   6 1
            5     2   7 1
            6     2   8 1 #Down
            7     3   9 1
            8     3  10 1 #Down
            9     4  11 1
            10    4  12 2
            11    5  13 1
            12    6  14 1 #Up
            13    6  15 1
            14    7  16 1
            15    8  17 2
            16    9  18 1
            17   11  19 2
            18   12  20 1
            19   14  21 1
            20   16  22 1
            21   18  23 1
            22   19  24 1
            23   19  25 1
            24   22  26 1
            25   22  27 1 #Up
            26   22  28 1 #Down
            27   26  29 1
            28    9  16 1
            29    9  17 1 #Down
            30   10  11 1
            31   12  15 1
            32   14  13 1 #Up
            33   20  24 2
            34   29  30 1
            35    1   2 1
            36   25  31 1
            37   31  32 1
            38   31  33 2

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