KEGG   DRUG: Norcholestenol iodomethyl (131I)
Entry
D02043                      Drug                                   
Name
Norcholestenol iodomethyl (131I) (JAN);
Adosterol (TN)
Formula
C27H45IO
Exact mass
516.2532
Mol weight
512.5501
Structure
Simcomp
Remark
Same as: C13547
Therapeutic category: 4300
Product: D02043<JP>
Efficacy
Diagnostic aid, Radioactive agent
Interaction
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  43  Radioactive drugs
   430  Radioactive drugs
    4300  Radioactive drugs
     D02043  Norcholestenol iodomethyl (131I) (JAN)
Other DBs
CAS: 56897-09-7
PubChem: 7849105
ChEBI: 34893
LigandBox: D02043
LinkDB
KCF data

ATOM        29
            1   C1x C    10.5000   -7.7700
            2   C1y C    10.5000   -9.1700
            3   C1x C    11.7124   -9.8700
            4   C2y C    12.9249   -9.1700
            5   C2y C    12.9249   -7.7700
            6   C1x C    11.7124   -7.0700
            7   C1y C    14.1373   -9.8700
            8   C1x C    15.3497   -9.1700
            9   C1y C    15.3497   -7.7700
            10  C1y C    14.1373   -7.0700
            11  C1y C    16.5622   -7.0700
            12  C1z C    16.5622   -5.6700
            13  C1x C    15.3497   -4.9700
            14  C1x C    14.1373   -5.6700
            15  C1x C    18.9870   -7.0700
            16  C1x C    18.9870   -5.6700
            17  C1y C    17.7746   -4.9700
            18  O1a O     9.2876   -9.8700
            19  C1b C    14.1373  -11.2700
            20  C1a C    16.5622   -4.2700
            21  C1c C    17.7746   -3.5700
            22  C1b C    18.9911   -2.8677
            23  C1a C    16.5662   -2.8723
            24  X   I    12.9269  -11.9688
            25  C1b C    20.1886   -3.5592
            26  C1b C    21.3749   -2.8743
            27  C1c C    22.5667   -3.5626
            28  C1a C    23.7559   -2.8761
            29  C1a C    22.5667   -4.9697
BOND        32
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   11  15 1
            18   15  16 1
            19   16  17 1
            20   12  17 1
            21    2  18 1 #Up
            22    7  19 1 #Up
            23   12  20 1 #Up
            24   17  21 1 #Up
            25   21  22 1
            26   21  23 1 #Down
            27   19  24 1
            28   22  25 1
            29   25  26 1
            30   26  27 1
            31   27  28 1
            32   27  29 1

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