KEGG   DRUG: Benzoic acid
Entry
D00038                      Drug                                   
Name
Benzoic acid (JP18/USP);
Benzoic acid (TN)
Formula
C7H6O2
Exact mass
122.0368
Mol weight
122.1213
Structure
Simcomp
Remark
Same as: C00180
Therapeutic category: 7190 7319
Product: D00038<JP>
Efficacy
Antifungal, Antiseptic
Structure map
map07110  Benzoic acid family
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 7  Agents not mainly for therapeutic purpose
  71  Dispensing medicines
   719  Miscellaneous
    7190  Miscellaneous
     D00038  Benzoic acid (JP18/USP)
  73  Public health agents
   731  Antiseptics
    7319  Others
     D00038  Benzoic acid (JP18/USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Designated second-class OTC drugs
  Inorganic and organic chemicals
   Benzoic acid
    D00038  Benzoic acid (JP18/USP)
 Second-class OTC drugs
  Inorganic and organic chemicals
   Benzoic acid
    D00038  Benzoic acid (JP18/USP)
 Third-class OTC drugs
  Inorganic and organic chemicals
   Benzoic acid
    D00038  Benzoic acid (JP18/USP)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00038  Benzoic acid
Other DBs
CAS: 65-85-0
PubChem: 7847106
ChEBI: 30746
PDB-CCD: BEZ[PDBj]
LigandBox: D00038
NIKKAJI: J2.358B
LinkDB
KCF data

ATOM        9
            1   C8y C    21.2100  -16.9763
            2   C8x C    20.0003  -17.6676
            3   C8x C    22.4262  -17.6676
            4   C6a C    21.2037  -15.5809
            5   C8x C    20.0003  -19.0759
            6   C8x C    22.4262  -19.0759
            7   O6a O    22.4069  -14.8832
            8   O6a O    19.9938  -14.8897
            9   C8x C    21.2100  -19.7863
BOND        9
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     4   8 2
            8     5   9 2
            9     6   9 1

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