KEGG   DRUG: Morphine hydrochloride hydrate
Entry
D02271                      Drug                                   
Name
Morphine hydrochloride hydrate (JP18);
Morphine hydrochloride trihydrate;
Anpec (TN)
Formula
C17H19NO3. 3H2O. HCl
Exact mass
375.1449
Mol weight
375.8444
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01564  Opioid receptor agonist
  DG01563  mu-Opioid receptor agonist
Analgesic
 DG01984  Opioid analgesics
Metabolizing enzyme substrate
 DG02924  UGT substrate
Remark
Therapeutic category: 8114
ATC code: N02AA01
Chemical structure group: DG00810
Product (DG00810): D00842<JP/US> D02271<JP>
Efficacy
Analgesic (narcotic), Opioid receptor agonist
Comment
Opium alkaloid
Target
OPRM1 [HSA:4988] [KO:K04215]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Metabolism
Enzyme: UGT [KO:K00699]
Interaction
Structure map
map07039  Opioid analgesics
map07224  Opioid receptor agonists/antagonists
Other map
map05032  Morphine addiction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N02 ANALGESICS
   N02A OPIOIDS
    N02AA Natural opium alkaloids
     N02AA01 Morphine
      D02271  Morphine hydrochloride hydrate (JP18) <JP>
USP drug classification [BR:br08302]
 Analgesics
  Opioid Analgesics, Long-acting
   Morphine
    D02271  Morphine hydrochloride hydrate (JP18)
  Opioid Analgesics, Short-acting
   Morphine
    D02271  Morphine hydrochloride hydrate (JP18)
Therapeutic category of drugs in Japan [BR:br08301]
 8  Narcotics
  81  Alkaloidal narcotics
   811  Opium alkaloids
    8114  Morphines
     D02271  Morphine hydrochloride hydrate (JP18)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01564  Opioid receptor agonist
   DG01563  mu-Opioid receptor agonist
    DG00810  Morphine
     D02271  Morphine hydrochloride hydrate
 Analgesic
  DG01984  Opioid analgesics
   DG00810  Morphine
    D02271  Morphine hydrochloride hydrate
 Metabolizing enzyme substrate
  DG02924  UGT substrate
   DG00810  Morphine
    D02271  Morphine hydrochloride hydrate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Opioid
    OPRM1
     D02271  Morphine hydrochloride hydrate (JP18) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D02271  Morphine hydrochloride hydrate
  D02271  Morphine hydrochloride tablets
  D02271  Morphine hydrochloride injection
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D02271
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG01564  Opioid receptor agonist
   DG01563  mu-Opioid receptor agonist
    DG00810  Morphine
 Analgesic
  DG01984  Opioid analgesics
   DG00810  Morphine
 Metabolizing enzyme substrate
  DG02924  UGT substrate
   DG00810  Morphine
Other DBs
CAS: 6055-06-7
PubChem: 7849330
ChEBI: 55348
LigandBox: D02271
LinkDB
KCF data

ATOM        25
            1   X   Cl   27.0190  -23.0527
            2   O0  O    27.2299  -20.5437
            3   C1z C    19.1395  -23.6495
            4   C8y C    19.1395  -22.3255
            5   C1y C    20.3241  -24.3462
            6   C1y C    18.0246  -24.2766
            7   C1x C    20.3241  -23.0224
            8   C8y C    18.0246  -21.6984
            9   C8y C    20.3241  -21.6984
            10  C1y C    21.4390  -23.6495
            11  C2x C    20.3241  -25.6005
            12  O2x O    16.7007  -22.9526
            13  C1y C    18.0246  -25.6005
            14  C1x C    22.5538  -23.0224
            15  C8y C    18.0246  -20.3745
            16  C1x C    21.4390  -22.3952
            17  C8x C    20.3241  -20.3745
            18  N1y N    22.5538  -24.3462
            19  C2x C    19.1395  -26.2973
            20  O1a O    16.9098  -26.2973
            21  C8x C    19.2092  -19.7474
            22  O1a O    16.9098  -19.7474
            23  C1a C    23.9527  -24.3462
            24  O0  O    27.2299  -20.5437
            25  O0  O    27.2299  -20.5437
BOND        25
            1     3   4 1
            2     3   5 1
            3     3   6 1
            4     3   7 1 #Up
            5     4   8 2
            6     4   9 1
            7     5  10 1
            8     5  11 1
            9     6  12 1 #Down
            10    6  13 1
            11    7  14 1
            12    8  15 1
            13    9  16 1
            14    9  17 2
            15   10  18 1 #Up
            16   11  19 2
            17   13  20 1 #Down
            18   15  21 2
            19   15  22 1
            20    8  12 1
            21   10  16 1
            22   13  19 1
            23   14  18 1
            24   17  21 1
            25   18  23 1
BRACKET     1    25.0600  -21.4200   25.0600  -19.5300
            1    27.9300  -19.5300   27.9300  -21.4200
            1  3
 ORIGINAL  1    2
 REPEAT    1   25  26

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