KEGG   DRUG: Diatrizoate meglumine
Entry
D02015                      Drug                                   
Name
Diatrizoate meglumine (USP);
Cystografin (TN);
Hypaque (TN);
Reno (TN);
Urovist (TN)
Product
CYSTOGRAFIN (BRACCO DIAGNOSTICS), CYSTOGRAFIN DILUTE (BRACCO DIAGNOSTICS)
Formula
C11H9I3N2O4. C7H17NO5
Exact mass
808.8803
Mol weight
809.1272
Structure
Simcomp
Remark
ATC code: V08AA01
Chemical structure group: DG01172
Product (DG01172): D01940<JP/US> D02015<US>
Product (mixture): D01940<JP/US>
Efficacy
Diagnostic aid (radiopaque medium)
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
     V08AA01 Diatrizoic acid
      D02015  Diatrizoate meglumine (USP) <US>
Other DBs
CAS: 131-49-7
PubChem: 7849077
ChEBI: 31812
LigandBox: D02015
NIKKAJI: J1.589.721J J482.705H
KCF data

ATOM        33
            1   C8y C    18.9112  -20.7618
            2   C8y C    20.1267  -20.1073
            3   C8y C    20.1267  -18.7048
            4   C8y C    18.9579  -18.0035
            5   C8y C    17.7424  -18.7048
            6   C8y C    17.7424  -20.0606
            7   N1b N    16.4801  -20.7618
            8   X   I    16.5269  -17.9568
            9   C6a C    18.9579  -16.6010
            10  O6a O    20.1735  -15.8997
            11  O6a O    17.7424  -15.8997
            12  X   I    21.3423  -18.0035
            13  N1b N    21.3423  -20.8086
            14  X   I    18.9112  -22.1644
            15  C5a C    15.2646  -20.0138
            16  C1a C    14.0491  -20.7151
            17  O5a O    15.2646  -18.6113
            18  C5a C    22.5578  -20.1073
            19  C1a C    23.7733  -20.8086
            20  O5a O    22.5578  -18.7048
            21  C1a C    27.6939  -20.8135
            22  N1b N    28.9079  -20.1131
            23  C1b C    30.1219  -20.8135
            24  C1c C    31.3359  -20.1131
            25  C1c C    32.5499  -20.8135
            26  C1c C    33.7639  -20.1131
            27  C1c C    34.9779  -20.7668
            28  C1b C    36.1453  -20.0664
            29  O1a O    37.3592  -20.7668
            30  O1a O    31.3359  -18.7123
            31  O1a O    32.5499  -22.2142
            32  O1a O    33.7172  -18.7123
            33  O1a O    34.9779  -22.2142
BOND        32
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   1 2
            7     6   7 1
            8     5   8 1
            9     4   9 1
            10    9  10 1
            11    9  11 2
            12    3  12 1
            13    2  13 1
            14    1  14 1
            15    7  15 1
            16   15  16 1
            17   15  17 2
            18   13  18 1
            19   18  19 1
            20   18  20 2
            21   21  22 1
            22   22  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   24  30 1 #Down
            30   25  31 1 #Down
            31   26  32 1 #Down
            32   27  33 1 #Up

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Ontology (1)   
   KEGG BRITE (1)   
Drug (3)   
   KEGG DGROUP (1)   
   LigandBox (1)   
   SIDER (1)   
Chemical substance (4)   
   PubChem (1)   
   ChEBI (1)   
   NIKKAJI (2)   
All databases (8)   

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