KEGG   DRUG: 3-Iodobenzylguanidine (123I)
Entry
D01729                      Drug                                   
Name
3-Iodobenzylguanidine (123I) (JAN);
m-Iodobenzylguanidine-123I;
MyoMIBG-I 123 (TN)
Formula
C8H10IN3
Exact mass
270.9931
Mol weight
275.0896
Structure
Simcomp
Remark
Therapeutic category: 4300
ATC code: V09IX01
Chemical structure group: DG01193
Product (DG01193): D01729<JP> D04559<US>
Efficacy
Diagnostic aid, Radioactive agent
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V09 DIAGNOSTIC RADIOPHARMACEUTICALS
   V09I TUMOUR DETECTION
    V09IX Other diagnostic radiopharmaceuticals for tumour detection
     V09IX01 Iobenguane (123I)
      D01729  3-Iodobenzylguanidine (123I) (JAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  43  Radioactive drugs
   430  Radioactive drugs
    4300  Radioactive drugs
     D01729  3-Iodobenzylguanidine (123I) (JAN)
Other DBs
CAS: 76924-93-1
PubChem: 7848792
ChEBI: 135134 32348
LigandBox: D01729
NIKKAJI: J397.920B
LinkDB
KCF data

ATOM        12
            1   C8x C    23.6600  -15.8900
            2   C8x C    22.4700  -15.1900
            3   C8y C    23.6600  -17.2900
            4   C8x C    21.2800  -15.8900
            5   C8x C    22.4700  -17.9200
            6   C8y C    21.2800  -17.2200
            7   X   I    19.7400  -18.2700
            8   C1b C    24.8500  -17.9900
            9   N1b N    25.9700  -17.2900
            10  C2c C    27.1600  -17.9900
            11  N1a N    28.3500  -17.2900
            12  N2a N    27.1600  -19.3200
BOND        12
            1     4   6 2
            2     5   6 1
            3     6   7 1
            4     3   8 1
            5     1   2 2
            6     8   9 1
            7     1   3 1
            8     9  10 1
            9     2   4 1
            10   10  11 1
            11    3   5 2
            12   10  12 2

» Japanese version   » Back

DBGET integrated database retrieval system