KEGG   DRUG: Technetium Tc 99m sestamibiHelp
Entry
D01060                      Drug                                   

Name
Technetium Tc 99m sestamibi (USP);
Technetium (99mTc) sestamibi (INN)
Product
  Generic
Formula
C36H66N6O6Tc
Exact mass
775.4107
Mol weight
777.852
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
ATC code: 
Efficacy
Diagnostic aid, Radioactive agent
Comment
Diagnostic aid (radiopaque medium, cardiac perfusion)
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 V VARIOUS
  V09 DIAGNOSTIC RADIOPHARMACEUTICALS
   V09G CARDIOVASCULAR SYSTEM
    V09GA Technetium (99mTc) compounds
     V09GA01 Technetium (99mTc) sestamibi
      D01060  Technetium Tc 99m sestamibi (USP)
BRITE hierarchy
Other DBs
CAS: 
109581-73-9
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        49
            1   Z   Tc    5.3000  -12.3708
            2   C2b C     6.1728  -12.3750
            3   C2b C     4.4689  -12.3708
            4   C2b C     4.7958  -13.1166
            5   C2b C     5.7968  -13.1135
            6   N2b N     5.3844  -13.7814
            7   N2b N     4.0115  -13.1154
            8   C2b C     4.9664  -11.5420
            9   C2b C     5.8829  -11.6292
            10  N2b N     6.5849  -11.6272
            11  N2b N     5.5044  -10.8407
            12  C1b C     6.3365  -10.8409
            13  C1b C     6.9397  -12.2294
            14  C1b C     6.3273  -13.5353
            15  C1b C     4.5641  -13.7532
            16  C1b C     3.6042  -12.4087
            17  C1b C     4.4689  -10.9419
            18  C1d C     6.7491  -10.1223
            19  N2b N     6.5883  -12.8377
            20  C1d C     7.6458  -12.2274
            21  C1d C     6.8050  -14.1102
            22  C1d C     4.1274  -14.4448
            23  N2b N     4.0137  -11.6991
            24  C1d C     2.7834  -12.4074
            25  C1d C     4.0903  -10.2503
            26  C1a C     7.0283   -9.3683
            27  C1a C     6.1700   -9.5328
            28  O2a O     7.6657  -10.2141
            29  C1a C     8.2909   -9.4245
            30  C1a C     8.3881  -11.8880
            31  C1a C     7.4555  -11.4233
            32  O2a O     7.9233  -12.9516
            33  C1a C     8.8268  -12.9526
            34  C1a C     7.3773  -14.6493
            35  C1a C     7.4146  -13.7416
            36  O2a O     6.4189  -14.7313
            37  C1a C     6.7772  -15.3768
            38  C1a C     4.1196  -15.2507
            39  C1a C     4.8994  -14.8058
            40  O2a O     3.2637  -14.4341
            41  C1a C     2.8205  -15.1822
            42  C1a C     1.9512  -12.3965
            43  C1a C     2.3781  -13.1046
            44  O2a O     2.2356  -11.6651
            45  C1a C     1.3001  -11.6630
            46  C1a C     3.6729   -9.4547
            47  C1a C     3.2997  -10.2502
            48  O2a O     4.4880   -9.4475
            49  C1a C     4.0811   -8.7027
BOND        48
            1    17  25 1
            2    11  12 1
            3    18  26 1
            4     5   6 2
            5    18  27 1
            6    10  13 1
            7    18  28 1
            8     1   2 1
            9    28  29 1
            10   19  14 1
            11   20  30 1
            12    4   7 2
            13   20  31 1
            14    6  15 1
            15   20  32 1
            16    3  23 2
            17   32  33 1
            18    7  16 1
            19   21  34 1
            20    1   4 1
            21   21  35 1
            22   23  17 1
            23   21  36 1
            24    1   8 1
            25   36  37 1
            26   12  18 1
            27   22  38 1
            28   22  39 1
            29    1   9 1
            30   22  40 1
            31   13  20 1
            32   40  41 1
            33    1   5 1
            34   24  42 1
            35   14  21 1
            36   24  43 1
            37    9  10 2
            38   24  44 1
            39   15  22 1
            40   44  45 1
            41    2  19 2
            42   25  46 1
            43    8  11 2
            44   25  47 1
            45   16  24 1
            46   25  48 1
            47    1   3 1
            48   48  49 1

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