KEGG   DRUG: IsofluraneHelp
Entry
D00545                      Drug                                   

Name
Isoflurane (JP17/USP/INN);
Forane (TN)
Product
  Generic
Formula
C3H2ClF5O
Exact mass
183.9714
Mol weight
184.4924
Structure
Mol fileKCF fileDB searchJmolKegDraw
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG02027  General anesthetics
   DG02028  Inhalational anaesthetics
    DG01994  Halogenated hydrocarbons
 DG02027  General anesthetics
  DG02028  Inhalational anaesthetics
   DG01994  Halogenated hydrocarbons
 DG01994  Halogenated hydrocarbons
Remark
Same as: 
Therapeutic category: 
ATC code: 
Activity
Anesthetic (inhalation)
Comment
Halogenated alkane derivative
Metabolism
Enzyme: CYP2E1 [HSA:1571]
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01A ANESTHETICS, GENERAL
    N01AB Halogenated hydrocarbons
     N01AB06 Isoflurane
      D00545  Isoflurane (JP17/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   111  General anesthetics
    1119  Others
     D00545  Isoflurane (JP17/USP/INN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00545  Isoflurane
Anesthetics, analgesics and anti-inflammatory drugs [br08369.html]
 Anesthetics
  D00545
BRITE hierarchy
Other DBs
CAS: 
26675-46-7
PubChem: 
ChEBI: 
ChEMBL: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        10
            1   C1d C    21.3153  -17.0799
            2   C1c C    22.5284  -16.3800
            3   X   F    20.1020  -16.3859
            4   X   F    21.3210  -18.4797
            5   X   F    21.3794  -15.6743
            6   O2a O    23.7357  -17.0799
            7   X   Cl   22.5284  -14.9802
            8   C1c C    24.9488  -16.3800
            9   X   F    26.1620  -17.0799
            10  X   F    24.9430  -14.9802
BOND        9
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     6   8 1
            8     8   9 1
            9     8  10 1

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