KEGG   DRUG: Ioglycamic acid
Entry
D04577                      Drug                                   
Name
Ioglycamic acid (USAN/INN)
Formula
C18H10I6N2O7
Exact mass
1127.4756
Mol weight
1127.71
Structure
Simcomp
Remark
ATC code: V08AC03
Efficacy
Diagnostic aid (radiopaque medium, cholecystographic)
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V08 CONTRAST MEDIA
   V08A X-RAY CONTRAST MEDIA, IODINATED
    V08AC Watersoluble, hepatotropic X-ray contrast media
     V08AC03 Ioglycamic acid
      D04577  Ioglycamic acid (USAN/INN)
Other DBs
CAS: 2618-25-9
PubChem: 47206421
LigandBox: D04577
NIKKAJI: J7.632E
LinkDB
KCF data

ATOM        33
            1   C8x C    18.9113  -17.6925
            2   C8y C    18.9113  -16.2923
            3   C8y C    20.1249  -18.3926
            4   C8y C    20.1249  -15.5923
            5   X   I    17.6919  -15.5864
            6   C8y C    21.3384  -17.6984
            7   X   I    20.1189  -19.7928
            8   C8y C    21.3384  -16.2982
            9   C6a C    20.1249  -14.1921
            10  N1b N    22.5520  -18.3869
            11  X   I    22.5520  -15.5807
            12  O6a O    18.9113  -13.4920
            13  O6a O    21.3384  -13.4920
            14  C5a C    23.7595  -17.6868
            15  C1b C    24.9672  -18.3809
            16  O5a O    23.7538  -16.2865
            17  O2a O    26.1822  -17.6761
            18  C1b C    27.4089  -18.3806
            19  C5a C    28.6295  -17.6718
            20  N1b N    29.8303  -18.3606
            21  O5a O    28.6258  -16.2400
            22  C8y C    31.0419  -17.6567
            23  C8y C    32.2250  -18.3355
            24  C8x C    33.4356  -17.6322
            25  C8y C    33.4318  -16.2322
            26  C8y C    32.2487  -15.5534
            27  C8y C    31.0381  -16.2567
            28  X   I    29.7954  -15.5437
            29  X   I    32.2289  -19.7397
            30  X   I    34.6597  -15.5185
            31  C6a C    32.2446  -14.1402
            32  O6a O    31.0493  -13.4544
            33  O6a O    33.4740  -13.4256
BOND        34
            1     1   2 1
            2     1   3 2
            3     2   4 2
            4     2   5 1
            5     3   6 1
            6     3   7 1
            7     4   8 1
            8     4   9 1
            9     6  10 1
            10    8  11 1
            11    9  12 2
            12    9  13 1
            13   10  14 1
            14   14  15 1
            15   14  16 2
            16    6   8 2
            17   15  17 1
            18   17  18 1
            19   18  19 1
            20   19  20 1
            21   19  21 2
            22   20  22 1
            23   22  23 2
            24   23  24 1
            25   24  25 2
            26   25  26 1
            27   26  27 2
            28   22  27 1
            29   27  28 1
            30   23  29 1
            31   25  30 1
            32   26  31 1
            33   31  32 1
            34   31  33 2

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