KEGG   DRUG: Fenticonazole nitrateHelp
Entry
D02583                      Drug                                   

Name
Fenticonazole nitrate (USAN);
Lomexin (TN)
Formula
C24H20Cl2N2OS. HNO3
Exact mass
517.063
Mol weight
518.4122
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antifungal
 DG01883  Imidazole antifungal
Remark
ATC code: D01AC12 G01AF12
Chemical structure group: DG00368
Efficacy
Antifungal, Ergosterol biosynthesis inhibitor
Comment
Imidazole derivative
Target
sterol 14alpha-demethylase [KO:K05917]
  Pathway
ko00100  Steroid biosynthesis
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D01 ANTIFUNGALS FOR DERMATOLOGICAL USE
   D01A ANTIFUNGALS FOR TOPICAL USE
    D01AC Imidazole and triazole derivatives
     D01AC12 Fenticonazole
      D02583  Fenticonazole nitrate (USAN)
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G01 GYNECOLOGICAL ANTIINFECTIVES AND ANTISEPTICS
   G01A ANTIINFECTIVES AND ANTISEPTICS, EXCL. COMBINATIONS WITH CORTICOSTEROIDS
    G01AF Imidazole derivatives
     G01AF12 Fenticonazole
      D02583  Fenticonazole nitrate (USAN)
BRITE hierarchy
Other DBs
CAS: 73151-29-8
PubChem: 17396754
ChEBI: 83606
ChEMBL: CHEMBL2107703
LigandBox: D02583
NIKKAJI: J311.650F
KCF data Show

ATOM        34
            1   C8y C    34.4521  -15.6263
            2   C1c C    34.4521  -14.2247
            3   C8y C    33.2375  -16.3271
            4   C8x C    35.6726  -16.3271
            5   C1b C    35.6669  -13.5182
            6   O2a O    33.2433  -13.5182
            7   C8x C    33.2375  -17.7287
            8   X   Cl   32.0110  -15.6263
            9   C8x C    35.6726  -17.7287
            10  N4y N    36.8756  -14.2306
            11  C1b C    32.0287  -14.2247
            12  C8y C    34.4521  -18.4352
            13  C8x C    37.9969  -13.3896
            14  C8x C    37.3226  -15.5478
            15  C8y C    30.8197  -13.5182
            16  X   Cl   34.4404  -19.8311
            17  C8x C    39.1282  -14.1972
            18  N5x N    38.7202  -15.5300
            19  C8x C    29.6109  -14.2247
            20  C8x C    30.8197  -12.1166
            21  C8x C    28.3903  -13.5182
            22  C8x C    29.6109  -11.4157
            23  C8y C    28.3903  -12.1166
            24  S2a S    27.1698  -11.4157
            25  C8y C    25.9600  -12.1182
            26  C8x C    24.7657  -11.4323
            27  C8x C    23.5535  -12.1357
            28  C8x C    23.4868  -13.5371
            29  C8x C    24.7511  -14.2230
            30  C8x C    25.9632  -13.5196
            31  N2b N    28.6649  -18.7448 #+
            32  O1b O    27.4560  -19.4339
            33  O3a O    28.6590  -17.3432
            34  O3a O    29.8737  -19.4456 #-
BOND        36
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 1
            11    7  12 2
            12   10  13 1
            13   10  14 1
            14   11  15 1
            15   12  16 1
            16   13  17 2
            17   14  18 2
            18   15  19 1
            19   15  20 2
            20   19  21 2
            21   20  22 1
            22   21  23 1
            23   23  24 1
            24    9  12 1
            25   17  18 1
            26   22  23 2
            27   24  25 1
            28   25  26 2
            29   26  27 1
            30   27  28 2
            31   28  29 1
            32   29  30 2
            33   25  30 1
            34   31  32 1
            35   31  33 2
            36   31  34 1

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