KEGG   DRUG: Gentian violetHelp
Entry
D01046                      Drug                                   

Name
Gentian violet (USP);
Methylrosanilinium chloride (JP17/INN);
Methylrosaniline chloride;
Crystal violet;
Genapax (TN)
Formula
C25H30N3. Cl
Exact mass
407.2128
Mol weight
407.9788
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
ATC code: 
Activity
Disinfectant
Comment
Methylrosaniline chloride (previously used name)
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D01 ANTIFUNGALS FOR DERMATOLOGICAL USE
   D01A ANTIFUNGALS FOR TOPICAL USE
    D01AE Other antifungals for topical use
     D01AE02 Methylrosaniline
      D01046  Gentian violet (USP)
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AX Other antiinfectives and antiseptics
     G01AX09 Methylrosaniline
      D01046  Gentian violet (USP)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for integumentary system
  56 Purulent skin remedies
   D01046  Gentian violet (USP)
 Agents for dental and stomatological use
  73 Stomatologic and laryngologic remedies (incl. toche without claims for cough and phlegm)
   D01046  Gentian violet (USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Methylrosanilinium chloride
    D01046  Gentian violet (USP)
Pharmaceutical additives [BR:br08316]
 Coloring agent
  D01046  [001112] Methylrosanilinium chloride
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01046  Methylrosanilinium chloride
BRITE hierarchy
Other DBs
CAS: 
548-62-9
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        29
            1   C8x C    23.8057  -21.6412
            2   C8y C    23.8057  -23.0422
            3   C8x C    25.0190  -23.7427
            4   C8x C    26.2324  -23.0422
            5   C8y C    26.2324  -21.6412
            6   C8x C    25.0190  -20.9406
            7   C8x C    28.6590  -23.0422
            8   C8y C    28.6590  -21.6412
            9   C2c C    27.4457  -20.9406
            10  C8x C    29.8724  -23.7427
            11  C8y C    31.0857  -23.0422
            12  C8x C    31.0857  -21.6412
            13  C8x C    29.8724  -20.9406
            14  C2y C    27.4457  -19.5396
            15  C2x C    28.6611  -18.8379
            16  C2x C    28.6611  -17.4368
            17  C2y C    27.4477  -16.7363
            18  C2x C    26.2324  -17.4380
            19  C2x C    26.2324  -18.8391
            20  N1c N    22.5924  -23.7427
            21  C1a C    21.3960  -23.0518
            22  C1a C    22.5923  -25.1436
            23  N1c N    32.3031  -23.7450
            24  C1a C    33.5015  -23.0530
            25  C1a C    32.3031  -25.1436
            26  N2b N    27.4477  -15.3365 #+
            27  C1a C    26.2349  -14.6363
            28  C1a C    28.6616  -14.6357
            29  X   Cl   30.7409  -16.2472 #-
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    9  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 1
            20   18  19 2
            21   14  19 1
            22    2  20 1
            23   20  21 1
            24   20  22 1
            25   11  23 1
            26   23  24 1
            27   23  25 1
            28   17  26 2
            29   26  27 1
            30   26  28 1

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