KEGG   DRUG: Tenofovir alafenamide monofumarate
Entry
D13304                      Drug                                   
Name
Tenofovir alafenamide monofumarate (USAN)
Formula
C21H29N6O5P. C4H4O4
Exact mass
592.2047
Mol weight
592.54
Structure
Class
Antiviral
 DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
 DG03107  Anti-HIV agent
  DG01656  HIV reverse transcriptase inhibitor
Remark
ATC code: J05AF13
Chemical structure group: DG01223
Product (DG01223): D01982<JP/US> D10605<JP/US>
Efficacy
Antiviral, Reverse transcriptase inhibitor
Comment
Prevention or treatment of HIV infection
Target
HIV-1 reverse transcriptase [KO:K24802]
  Pathway
ko03230  Viral genome structure
ko03240  Viral replication
ko03250  Viral life cycle - HIV-1
ko03260  Virion - Human immunodeficiency virus
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
     J05AF13 Tenofovir alafenamide
      D13304  Tenofovir alafenamide monofumarate (USAN)
Drug groups [BR:br08330]
 Antiviral
  DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
   DG01223  Tenofovir
    D13304  Tenofovir alafenamide monofumarate
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    DG01223  Tenofovir
     D13304  Tenofovir alafenamide monofumarate
Drug groups [BR:br08330]
 Antiviral
  DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
   DG01223  Tenofovir
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    DG01223  Tenofovir
Other DBs
PubChem: 528403377
LinkDB
KCF data

ATOM        41
            1   N5x N    21.4200  -12.8800
            2   C8x C    21.4200  -14.3500
            3   N5x N    20.2300  -15.0500
            4   C8y C    19.0400  -14.3500
            5   C8y C    19.0400  -12.8800
            6   C8y C    20.2300  -12.1800
            7   N4y N    17.7100  -14.7700
            8   C8x C    16.9400  -13.6500
            9   N5x N    17.7100  -12.4600
            10  N1a N    20.2300  -10.8500
            11  C1b C    17.7100  -16.1700
            12  C1c C    16.5200  -16.8700
            13  O2a O    15.2600  -16.1700
            14  C1b C    14.2100  -16.8700
            15  P1a P    12.9500  -16.1700
            16  C1a C    16.5200  -18.2000
            17  O2b O    11.6900  -15.4700
            18  O3b O    13.6500  -14.9100
            19  N1b N    11.8300  -17.3600
            20  C8y C    10.2900  -15.4700
            21  C8x C     9.5900  -14.2800
            22  C8x C     8.1900  -14.2800
            23  C8x C     7.4900  -15.4700
            24  C8x C     8.1900  -16.6600
            25  C8x C     9.5900  -16.6600
            26  C1c C    11.8300  -18.7600
            27  C7a C    10.6400  -19.4600
            28  C1a C    13.0200  -19.4600
            29  O7a O     9.4500  -18.7600
            30  O6a O    10.6400  -20.8600
            31  C1c C     8.2600  -19.4600
            32  C1a C     7.0700  -18.7600
            33  C1a C     8.2600  -20.8600
            34  C6a C    27.7900  -16.5900
            35  C2b C    28.9800  -17.2900
            36  O6a O    26.6000  -17.2900
            37  O6a O    27.7900  -15.1900
            38  C2b C    30.1700  -16.5900
            39  C6a C    31.3600  -17.2900
            40  O6a O    32.5500  -16.5900
            41  O6a O    31.3600  -18.6900
BOND        42
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    6  10 1
            12    7  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   12  16 1 #Up
            18   15  17 1 #Up
            19   15  18 2
            20   15  19 1 #Down
            21   17  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   20  25 1
            28   19  26 1
            29   26  27 1
            30   26  28 1 #Up
            31   27  29 1
            32   27  30 2
            33   29  31 1
            34   31  32 1
            35   31  33 1
            36   34  35 1
            37   34  36 1
            38   34  37 2
            39   35  38 2
            40   38  39 1
            41   39  40 1
            42   39  41 2

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