KEGG   DRUG: Esmethadone hydrochloride
Entry
D12215                      Drug                                   
Name
Esmethadone hydrochloride (USAN);
Dextromethadone hydrochloride
Formula
C21H27NO. HCl
Exact mass
345.1859
Mol weight
345.9061
Structure
Class
Neuropsychiatric agent
 DG01498  NMDA receptor antagonist
Remark
Chemical structure group: DG03176
Efficacy
Antidepressant, NMDA receptor antagonist
Comment
Treatment of depression
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04724  Glutamatergic synapse
hsa04728  Dopaminergic synapse
Interaction
Brite
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01498  NMDA receptor antagonist
   DG03176  Esmethadone
    D12215  Esmethadone hydrochloride
Target-based classification of drugs [BR:br08310]
 Ion channels
  Ligand-gated ion channels
   Glutamate (ionotropic), NMDA
    GRIN (NMDAR)
     D12215  Esmethadone hydrochloride (USAN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01498  NMDA receptor antagonist
   DG03176  Esmethadone
Other DBs
CAS: 15284-15-8
LinkDB
KCF data

ATOM        24
            1   X   Cl   23.8823  -15.7122
            2   C8x C    14.1059  -17.5278
            3   C8x C    14.1059  -18.9245
            4   C8x C    15.2931  -19.6228
            5   C8x C    16.4802  -18.9245
            6   C8y C    16.4802  -17.5278
            7   C8x C    15.2931  -16.8994
            8   C8x C    18.7846  -18.9245
            9   C8y C    18.7846  -17.5278
            10  C1d C    17.5975  -16.8994
            11  C8x C    19.9718  -19.6228
            12  C8x C    21.1589  -18.9245
            13  C8x C    21.1589  -17.5278
            14  C8x C    19.9718  -16.8994
            15  C1b C    17.5975  -15.5027
            16  C1c C    18.7846  -14.8044
            17  C5a C    15.6422  -15.7821
            18  C1a C    19.9718  -15.5027
            19  N1c N    18.7846  -13.4776
            20  C1a C    19.9718  -12.7793
            21  C1a C    17.5975  -12.7793
            22  O5a O    15.6422  -14.4553
            23  C1b C    14.4551  -16.4804
            24  C1a C    13.3378  -15.7821
BOND        24
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     8   9 1
            8     9  10 1
            9     6  10 1
            10    8  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14    9  14 2
            15   10  15 1
            16   15  16 1
            17   10  17 1
            18   16  18 1 #Up
            19   16  19 1
            20   19  20 1
            21   19  21 1
            22   17  22 2
            23   17  23 1
            24   23  24 1

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