KEGG   DRUG: IoversolHelp
Entry
D01555                      Drug                                   

Name
Ioversol (JAN/USP/INN);
Optiray (TN)
Product
Formula
C18H24I3N3O9
Exact mass
806.8647
Mol weight
807.1113
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Therapeutic category: 7219
ATC code: V08AB07
Product: D01555<JP/US>
Efficacy
Diagnostic aid (radiopaque medium)
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V08 CONTRAST MEDIA
   V08A X-RAY CONTRAST MEDIA, IODINATED
    V08AB Watersoluble, nephrotropic, low osmolar X-ray contrast media
     V08AB07 Ioversol
      D01555  Ioversol (JAN/USP/INN) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 7  Agents not mainly for therapeutic purpose
  72  Intracorporeal diagnostic agents
   721  X-ray contrast media
    7219  Others
     D01555  Ioversol (JAN/USP/INN)
BRITE hierarchy
Other DBs
CAS: 87771-40-2
PubChem: 7848618
ChEBI: 31717
ChEMBL: CHEMBL1200614
LigandBox: D01555
NIKKAJI: J33.102C
LinkDB All DBs
KCF data Show

ATOM        33
            1   C5a C    24.2999  -13.9594
            2   N1b N    25.5147  -13.2600
            3   O5a O    23.0869  -13.2570
            4   C1b C    26.7203  -13.9594
            5   C1c C    27.9309  -13.2585
            6   C1b C    29.1415  -13.9594
            7   O1a O    30.3522  -13.2585
            8   O1a O    27.9309  -11.8567
            9   C8y C    24.2989  -15.3540
            10  C8y C    25.5166  -16.0549
            11  C8y C    25.5166  -17.4567
            12  C8y C    24.2997  -18.1576
            13  C8y C    23.0899  -17.4567
            14  C8y C    23.0899  -16.0549
            15  X   I    24.2980  -19.5593
            16  X   I    21.8754  -15.3550
            17  X   I    26.7303  -15.3535
            18  C5a C    21.8754  -18.1567
            19  N1b N    20.6670  -17.4497
            20  C1b C    19.4564  -18.1506
            21  C1c C    18.2457  -17.4497
            22  C1b C    17.0351  -18.1506
            23  O1a O    15.8245  -17.4497
            24  O5a O    21.9408  -19.5585
            25  O1a O    18.2457  -16.0479
            26  N1c N    26.7272  -18.1576
            27  C1b C    27.9379  -17.4638
            28  C1b C    29.1485  -18.1647
            29  C5a C    26.7201  -19.5524
            30  O5a O    25.5027  -20.2471
            31  C1b C    27.9306  -20.2594
            32  O1a O    30.3634  -17.4653
            33  O1a O    29.1586  -19.5588
BOND        33
            1     6   7 1
            2     5   8 1
            3     9   1 1
            4     1   2 1
            5     1   3 2
            6     2   4 1
            7     4   5 1
            8    11  12 1
            9    21  25 1
            10   10  17 1
            11   11  26 1
            12   12  13 2
            13   26  27 1
            14   13  18 1
            15   27  28 1
            16   13  14 1
            17   18  19 1
            18   14   9 2
            19   19  20 1
            20    9  10 1
            21   20  21 1
            22   21  22 1
            23   12  15 1
            24   22  23 1
            25   10  11 2
            26   18  24 2
            27   14  16 1
            28   26  29 1
            29   29  30 2
            30   29  31 1
            31    5   6 1
            32   28  32 1
            33   31  33 1

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