KEGG   DRUG: Etorphine
Entry
D07937                      Drug                                   
Name
Etorphine (INN)
Formula
C25H33NO4
Exact mass
411.241
Mol weight
411.5338
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01564  Opioid receptor agonist
Remark
Same as: C11793
Efficacy
Analgesic, Anesthetic, 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
Brite
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01564  Opioid receptor agonist
   D07937  Etorphine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D07937  Etorphine (INN)
    OPRK1
     D07937  Etorphine (INN)
    OPRD1
     D07937  Etorphine (INN)
Other DBs
CAS: 14521-96-1
PubChem: 96024632
ChEBI: 4912
LigandBox: D07937
LinkDB
KCF data

ATOM        30
            1   C1z C    18.0549  -15.8162
            2   C1z C    19.2447  -16.5161
            3   C1y C    16.8652  -16.5161
            4   C8y C    18.0549  -14.4865
            5   C1x C    19.2447  -15.1164
            6   C1y C    20.4344  -15.8862
            7   C1x C    19.2447  -17.9158
            8   C2x C    18.6848  -17.5658
            9   C1z C    16.8652  -17.8458
            10  O2x O    16.1653  -14.9764
            11  C8y C    16.8652  -13.7866
            12  C8y C    19.2447  -13.7866
            13  C1x C    21.6241  -15.1163
            14  N1y N    21.6241  -16.5161
            15  C1x C    20.4344  -14.4865
            16  C1y C    18.0549  -18.5456
            17  C2x C    17.4950  -16.8660
            18  O2a O    15.4655  -17.8458
            19  C8y C    16.8651  -12.3869
            20  C8x C    19.2447  -12.3869
            21  C1a C    22.8139  -15.8862
            22  C1d C    18.0549  -19.9453
            23  C1a C    14.3457  -18.8256
            24  C8x C    18.1249  -11.6871
            25  O1a O    15.6754  -11.6871
            26  C1b C    19.1747  -20.6452
            27  C1a C    16.7952  -20.5752
            28  O1a O    16.7952  -19.2455
            29  C1b C    20.3644  -19.9453
            30  C1a C    21.5542  -20.6452
BOND        35
            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

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