KEGG   DRUG: NifuratelHelp
Entry
D01050                      Drug                                   

Name
Nifuratel (USAN);
Macmiror (TN)
Formula
C10H11N3O5S
Exact mass
285.0419
Mol weight
285.2764
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01553  5-Nitrofuran antibacterial
Antifungal
 DG01555  5-Nitrofuran antifungal
Antiparasitic
 DG01554  5-Nitrofuran antiprotozoal
Remark
ATC code: G01AX05
Efficacy
Antibacterial, Antifungal, Antiprotozoal (trichomonas)
Comment
Nitrofuran derivative
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 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
     G01AX05 Nifuratel
      D01050  Nifuratel (USAN)
BRITE hierarchy
Other DBs
CAS: 4936-47-4
PubChem: 7848113
ChEMBL: CHEMBL514315
LigandBox: D01050
NIKKAJI: J8.785H
LinkDB All DBs
KCF data Show

ATOM        19
            1   C7x C    33.3810  -15.8496
            2   N1y N    33.3810  -17.2562
            3   N2b N    32.1854  -17.9595
            4   C2b C    30.9898  -17.3265
            5   C8y C    29.7942  -17.9595
            6   O2x O    28.6690  -17.1859
            7   C8y C    27.5437  -17.9595
            8   C8x C    27.9657  -19.2958
            9   C8x C    29.3019  -19.2958
            10  N2b N    26.2778  -17.2562 #+
            11  O3a O    25.0822  -17.9595 #-
            12  O3a O    26.2778  -15.8496
            13  C1x C    34.7876  -17.7485
            14  C1y C    35.5612  -16.5529
            15  O7x O    34.7876  -15.4277
            16  O6a O    32.2557  -15.0057
            17  C1b C    36.9677  -16.5332
            18  S2a S    37.6545  -15.3044
            19  C1a C    39.0545  -15.3044
BOND        20
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 2
            8     8   9 1
            9     5   9 2
            10    7  10 1
            11   10  11 1
            12   10  12 2
            13    2  13 1
            14   13  14 1
            15   14  15 1
            16    1  15 1
            17    1  16 2
            18   14  17 1
            19   17  18 1
            20   18  19 1

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