KEGG   DRUG: NifurtoinolHelp
Entry
D07243                      Drug                                   

Name
Nifurtoinol (INN);
Urfadyn (TN)
Formula
C9H8N4O6
Exact mass
268.0444
Mol weight
268.183
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01552  Hydantoin type nitrofuran
Remark
ATC code: J01XE02
Efficacy
Antibacterial
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01X OTHER ANTIBACTERIALS
    J01XE Nitrofuran derivatives
     J01XE02 Nifurtoinol
      D07243  Nifurtoinol (INN)
BRITE hierarchy
Other DBs
CAS: 1088-92-2
PubChem: 51091581
ChEBI: 88255
ChEMBL: CHEMBL1697763
LigandBox: D07243
NIKKAJI: J7.253B
LinkDB All DBs
KCF data Show

ATOM        19
            1   N1y N    22.7500  -16.3100
            2   C5x C    22.3300  -14.9800
            3   C1x C    21.0000  -14.9800
            4   N1y N    20.5800  -16.3100
            5   C5x C    21.6300  -17.1500
            6   O5x O    21.6300  -18.5500
            7   O5x O    23.1000  -13.8600
            8   N2b N    19.3900  -17.0100
            9   C2b C    18.2000  -16.3100
            10  C8y C    16.9400  -17.0100
            11  O2x O    15.8200  -16.1700
            12  C8y C    14.7000  -17.0100
            13  C8x C    15.1200  -18.3400
            14  C8x C    16.5200  -18.3400
            15  N2b N    13.5800  -16.3100 #+
            16  O3a O    12.1100  -17.2900 #-
            17  O3a O    13.5800  -14.9100
            18  C1b C    23.9400  -17.0100
            19  O1a O    25.1300  -16.3100
BOND        20
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     5   6 2
            7     2   7 2
            8     8   9 2
            9     8   4 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   10  14 2
            16   12  15 1
            17   15  16 1
            18   15  17 2
            19   18   1 1
            20   18  19 1

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