KEGG   DRUG: Chlorobutanol
Entry
D01942                      Drug                                   
Name
Chlorobutanol (JP18/NF/INN);
Chloretone (TN)
Formula
C4H7Cl3O
Exact mass
175.9562
Mol weight
177.45
Structure
Class
Gastrointestinal agent
 DG01762  Antiemetic
Remark
ATC code: A04AD04
Efficacy
Anesthetic (local), Sedative-hypnotic, Pharmaceutic aid (antimicrobial preservative)
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A04 ANTIEMETICS AND ANTINAUSEANTS
   A04A ANTIEMETICS AND ANTINAUSEANTS
    A04AD Other antiemetics
     A04AD04 Chlorobutanol
      D01942  Chlorobutanol (JP18/NF/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Chlorobutanol
    D01942  Chlorobutanol (JP18/NF/INN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01762  Antiemetic
   D01942  Chlorobutanol
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01942  Chlorobutanol
Other DBs
CAS: 57-15-8
PubChem: 7849004
LigandBox: D01942
NIKKAJI: J1.380C
LinkDB
KCF data

ATOM        8
            1   X   Cl   18.9000  -15.1900
            2   C1d C    20.3000  -15.1900
            3   C1d C    21.7000  -15.1900
            4   C1a C    23.1000  -15.1900
            5   O1a O    21.7000  -13.7900
            6   C1a C    21.7000  -16.5900
            7   X   Cl   20.3000  -13.7900
            8   X   Cl   20.3000  -16.5900
BOND        7
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     3   5 1
            5     3   6 1
            6     2   7 1
            7     2   8 1

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