KEGG   DRUG: Tenofovir disoproxil maleate
Entry
D11391                      Drug                                   

Name
Tenofovir disoproxil maleate
Formula
C19H30N5O10P. C4H4O4
Exact mass
635.184
Mol weight
635.5149
Structure
Simcomp
Remark
ATC code: J05AF07
Chemical structure group: DG01223
Product (DG01223): D01982<JP/US> D10605<JP/US>
Product (mixture): D11395<US> D11396<US>
Efficacy
Antiviral, Reverse transcriptase inhibitor
Target
HBV reverse transcriptase [KO:K21037]
HIV-1 reverse transcriptase [KO:K24802]
  Pathway
ko05161  Hepatitis B
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J05 ANTIVIRALS FOR SYSTEMIC USE
   J05A DIRECT ACTING ANTIVIRALS
    J05AF Nucleoside and nucleotide reverse transcriptase inhibitors
     J05AF07 Tenofovir disoproxil
      D11391  Tenofovir disoproxil maleate
Antiinfectives [BR:br08307]
 Antivirals
  Genome replication inhibitor
   HBV reverse transcriptase inhibitor
    D11391  Tenofovir disoproxil maleate
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D11391
Other DBs
CAS: 1276030-80-8
PubChem: 384585369
KCF data

ATOM        43
            1   C8y C    24.1342  -15.3190
            2   C8y C    24.1342  -13.8501
            3   N4y N    22.8051  -15.7387
            4   N5x N    25.3933  -15.9486
            5   N5x N    22.8051  -13.4304
            6   C8y C    25.3933  -13.2205
            7   C8x C    21.9657  -14.6195
            8   C8x C    26.5824  -15.3190
            9   N5x N    26.5824  -13.8501
            10  N1a N    25.3933  -11.8915
            11  C1b C    22.8051  -17.1377
            12  C1c C    21.6160  -17.8372
            13  O2a O    20.4268  -17.1377
            14  C1b C    19.1677  -17.8372
            15  P1b P    17.9786  -17.1377
            16  O2b O    16.7894  -16.4382
            17  O2b O    17.2791  -18.3269
            18  O3b O    18.6781  -15.9486
            19  C1b C    16.7894  -15.0392
            20  C1b C    17.2791  -19.7259
            21  O7a O    15.5303  -14.3397
            22  C7a C    14.3412  -15.0392
            23  O7a O    13.1520  -14.3397
            24  C1c C    11.8929  -15.0392
            25  C1a C    10.7038  -14.3397
            26  O7a O    16.0200  -20.4953
            27  C7a C    14.8308  -19.7958
            28  O7a O    13.6417  -20.4953
            29  C1c C    12.3826  -19.7958
            30  C1a C    11.1934  -20.4953
            31  O6a O    14.3412  -16.4382
            32  C1a C    11.8929  -16.4382
            33  O6a O    14.8308  -18.3968
            34  C1a C    12.3826  -18.3968
            35  C1a C    21.6160  -19.2362
            36  C2b C    28.7700  -18.0600
            37  C2b C    30.1700  -18.0600
            38  C6a C    30.8700  -19.2724
            39  C6a C    28.0700  -19.2724
            40  O6a O    26.6702  -19.2724
            41  O6a O    28.7604  -20.4679
            42  O6a O    32.2698  -19.2724
            43  O6a O    30.1796  -20.4679
BOND        43
            1     2   5 1
            2     2   6 1
            3     3   7 1
            4     4   8 2
            5     6   9 2
            6     5   7 2
            7     8   9 1
            8     1   2 2
            9     1   3 1
            10    1   4 1
            11    6  10 1
            12    3  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   15  17 1
            19   15  18 2
            20   16  19 1
            21   17  20 1
            22   19  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   20  26 1
            28   26  27 1
            29   27  28 1
            30   28  29 1
            31   29  30 1
            32   22  31 2
            33   24  32 1
            34   27  33 2
            35   29  34 1
            36   12  35 1 #Up
            37   36  37 2
            38   37  38 1
            39   36  39 1
            40   39  40 1
            41   39  41 2
            42   38  42 2
            43   38  43 1

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