KEGG   DRUG: Isoflurane
Entry
D00545                      Drug                                   
Name
Isoflurane (JP18/USP/INN);
Forane (TN)
Product
  Generic
Formula
C3H2ClF5O
Exact mass
183.9714
Mol weight
184.4924
Structure
Simcomp
Class
Neuropsychiatric agent
 DG02030  Anesthetics
  DG02027  General anesthetics
   DG02028  Inhalational anaesthetics
    DG01994  Halogenated hydrocarbons
Remark
Same as: C07518
Therapeutic category: 1119
ATC code: N01AB06
Product: D00545<JP/US>
Efficacy
Anesthetic (inhalation)
Comment
Halogenated alkane derivative
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N01 ANESTHETICS
   N01A ANESTHETICS, GENERAL
    N01AB Halogenated hydrocarbons
     N01AB06 Isoflurane
      D00545  Isoflurane (JP18/USP/INN) <JP/US>
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 (JP18/USP/INN)
Drug groups [BR:br08330]
 Neuropsychiatric agent
  DG02030  Anesthetics
   DG02027  General anesthetics
    DG02028  Inhalational anaesthetics
     DG01994  Halogenated hydrocarbons
      D00545  Isoflurane
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00545  Isoflurane
Other DBs
CAS: 26675-46-7
PubChem: 7847611
ChEBI: 6015
LigandBox: D00545
NIKKAJI: J2.770G
KCF data

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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