KEGG   DRUG: Iothalamate sodium I 125
Entry
D04595                      Drug                                   
Name
Iothalamate sodium I 125 (USP);
Sodium iotalamate (125I) (INN);
Glofil-125 (TN)
Product
Formula
C11H8I3N2O4. Na
Exact mass
629.752
Mol weight
635.8954
Structure
Simcomp
Remark
ATC code: V08AA04 V09CX03
Chemical structure group: DG01175
Product (DG01175): D01999<US> D04595<US>
Efficacy
Diagnostic aid, Radioactive agent
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V08 CONTRAST MEDIA
   V08A X-RAY CONTRAST MEDIA, IODINATED
    V08AA Watersoluble, nephrotropic, high osmolar X-ray contrast media
     V08AA04 Iotalamic acid
      D04595  Iothalamate sodium I 125 (USP) <US>
  V09 DIAGNOSTIC RADIOPHARMACEUTICALS
   V09C RENAL SYSTEM
    V09CX Other renal system diagnostic radiopharmaceuticals
     V09CX03 Sodium iothalamate (125I)
      D04595  Iothalamate sodium I 125 (USP) <US>
Other DBs
CAS: 17692-74-9
PubChem: 47206439
LigandBox: D04595
LinkDB
KCF data

ATOM        21
            1   C8y C    42.8636  -25.3261
            2   C8y C    42.8708  -26.7261
            3   C8y C    41.6619  -27.4322
            4   C8y C    40.4458  -26.7383
            5   C8y C    40.4389  -25.3383
            6   C8y C    41.6476  -24.6322
            7   X   I    39.2228  -24.6444
            8   X   I    41.6688  -28.8322
            9   X   I    44.0726  -24.6200
            10  C6a C    41.6407  -23.2322
            11  O6a O    40.4246  -22.5384
            12  O6a O    42.8496  -22.5261 #-
            13  C5a C    39.2369  -27.4444
            14  O5a O    39.2440  -28.8444
            15  N1b N    38.0212  -26.7505
            16  C1a C    36.8122  -27.4566
            17  N1b N    44.0866  -27.4200
            18  C5a C    45.2955  -26.7137
            19  C1a C    46.5114  -27.4076
            20  O5a O    45.2884  -25.3139
            21  Z   Na   45.0797  -22.5398 #+
BOND        20
            1     6  10 1
            2     4   5 1
            3    10  11 2
            4     5   6 2
            5    10  12 1
            6     6   1 1
            7     4  13 1
            8    13  14 2
            9     5   7 1
            10   13  15 1
            11    1   2 2
            12   15  16 1
            13    3   8 1
            14    2  17 1
            15    2   3 1
            16   17  18 1
            17    1   9 1
            18   18  19 1
            19    3   4 2
            20   18  20 2

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