KEGG   DRUG: OxyquinolineHelp
Entry
D05321                      Drug                                   

Name
Oxyquinoline (USAN)
Formula
C9H7NO
Exact mass
145.0528
Mol weight
145.158
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C19434
ATC code: A01AB07 D08AH03 G01AC30 R02AA14
Chemical structure group: DG00002
Efficacy
Disinfectant
Comment
Quinoline derivative
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A01 STOMATOLOGICAL PREPARATIONS
   A01A STOMATOLOGICAL PREPARATIONS
    A01AB Antiinfectives and antiseptics for local oral treatment
     A01AB07 Oxyquinoline
      D05321  Oxyquinoline (USAN)
 D DERMATOLOGICALS
  D08 ANTISEPTICS AND DISINFECTANTS
   D08A ANTISEPTICS AND DISINFECTANTS
    D08AH Quinoline derivatives
     D08AH03 Oxyquinoline
      D05321  Oxyquinoline (USAN)
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AC Quinoline derivatives
     G01AC30 Oxyquinoline
      D05321  Oxyquinoline (USAN)
 R RESPIRATORY SYSTEM
  R02 THROAT PREPARATIONS
   R02A THROAT PREPARATIONS
    R02AA Antiseptics
     R02AA14 Oxyquinoline
      D05321  Oxyquinoline (USAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Oxyquinoline
    D05321  Oxyquinoline (USAN)
BRITE hierarchy
Other DBs
CAS: 148-24-3
PubChem: 47207016
ChEBI: 48981
ChEMBL: CHEMBL310555
PDB-CCD: HQY[PDBj]
LigandBox: D05321
NIKKAJI: J2.960B
LinkDB All DBs
KCF data Show

ATOM        11
            1   C8x C    20.3602  -17.1927
            2   C8x C    20.3602  -18.5998
            3   C8x C    21.5826  -19.3068
            4   C8y C    21.5826  -16.4926
            5   C8y C    22.8211  -17.1927
            6   C8y C    22.7919  -18.5998
            7   C8x C    24.0084  -19.3119
            8   C8x C    25.2309  -18.6101
            9   C8x C    25.1900  -17.2030
            10  N5x N    24.0204  -16.4979
            11  O1a O    21.5843  -15.1326
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   6 2
            4     5   6 1
            5     6   7 1
            6     7   8 2
            7     8   9 1
            8     9  10 2
            9    10   5 1
            10    5   4 2
            11    4  11 1
            12    4   1 1

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