KEGG   COMPOUND: C07662Help
Entry
C07662                      Compound                               

Name
Sparfloxacin;
cis-5-Amino-1-cyclopropyl-7-(3,5-dimethyl-1-piperazinyl)-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid
Formula
C19H22F2N4O3
Exact mass
392.166
Mol weight
392.3998
Structure
Mol fileKCF fileDB search
Remark
Same as: D00590
Pathway
map02010  ABC transporters
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01M QUINOLONE ANTIBACTERIALS
    J01MA Fluoroquinolones
     J01MA09 Sparfloxacin
      D00590  Sparfloxacin (JAN/USAN/INN)
BRITE hierarchy
Other DBs
CAS: 110871-86-8
PubChem: 9864
ChEBI: 9212
ChEMBL: CHEMBL850
NIKKAJI: J324.247A
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8y C    26.0745  -16.6053
            2   C8y C    26.0745  -15.2064
            3   N4y N    27.2868  -17.3048
            4   C8y C    24.8620  -17.3048
            5   C8y C    27.2402  -14.5069
            6   C8y C    24.8620  -14.5069
            7   C1y C    27.2868  -18.7037
            8   C8x C    28.4992  -16.5587
            9   C8y C    23.6496  -16.6053
            10  X   F    24.8620  -18.7037
            11  C8y C    28.4992  -15.1598
            12  O5x O    27.2402  -13.1080
            13  C8y C    23.6496  -15.2064
            14  N1a N    24.8620  -13.1080
            15  C1x C    27.9863  -19.9162
            16  C1x C    26.5407  -19.8695
            17  C6a C    29.6650  -14.4603
            18  X   F    22.4372  -14.5069
            19  O6a O    30.8774  -15.2064
            20  O6a O    29.6650  -13.0614
            21  N1y N    22.4372  -17.3048
            22  C1x C    21.2248  -16.6053
            23  C1y C    20.0124  -17.3048
            24  N1x N    20.0124  -18.7037
            25  C1y C    21.2248  -19.4032
            26  C1x C    22.4372  -18.7037
            27  C1a C    21.2714  -20.8021
            28  C1a C    18.8000  -16.6053
BOND        31
            1     1   2 2
            2     1   3 1
            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     4  10 1
            10    5  11 1
            11    5  12 2
            12    6  13 2
            13    6  14 1
            14    7  15 1
            15    7  16 1
            16   11  17 1
            17   13  18 1
            18   17  19 1
            19   17  20 2
            20    8  11 2
            21    9  13 1
            22   15  16 1
            23    9  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   21  26 1
            30   25  27 1 #Up
            31   23  28 1 #Up

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