KEGG   DRUG: Doxribtimine
Entry
D12466                      Drug                                   
Name
Doxribtimine (USAN/INN)
Formula
C10H14N2O5
Exact mass
242.0903
Mol weight
242.2286
Structure
Remark
Same as: C00214
Efficacy
Methabolic disease therapeutic agent
Comment
Treatment of thymidine kinase 2 deficiency
Target
TK2 [HSA:7084] [KO:K00857]
  Pathway
hsa00240  Pyrimidine metabolism
hsa00983  Drug metabolism - other enzymes
hsa01232  Nucleotide metabolism
Brite
Target-based classification of drugs [BR:br08310]
 Enzymes
  Transferases (EC2)
   Phosphotransferase
    TK2
     D12466  Doxribtimine (USAN/INN)
Other DBs
CAS: 50-89-5
PDB-CCD: THM[PDBj]
LinkDB
KCF data

ATOM        17
            1   C1y C    18.4887  -16.5203
            2   O2x O    17.3639  -15.6768
            3   C1x C    18.0669  -17.8560
            4   C1y C    16.2391  -16.5203
            5   C1y C    16.6609  -17.8560
            6   C1b C    14.9035  -16.0985
            7   O1a O    16.2391  -19.1917
            8   O1a O    13.8490  -17.0124
            9   N4y N    19.8243  -16.2391
            10  C8y C    21.0194  -16.9421
            11  C8x C    19.8243  -14.8332
            12  N4x N    22.2145  -16.2391
            13  O5x O    21.0191  -18.3481
            14  C8y C    21.0194  -14.1302
            15  C8y C    22.2145  -14.8332
            16  C1a C    21.0194  -12.7242
            17  O5x O    23.4798  -14.1302
BOND        18
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     4   6 1 #Up
            6     5   7 1 #Down
            7     6   8 1
            8     4   5 1
            9     9  10 1
            10    9  11 1
            11   10  12 1
            12   10  13 2
            13   11  14 2
            14   12  15 1
            15   14  16 1
            16   15  17 2
            17   14  15 1
            18    1   9 1 #Up

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