KEGG   DRUG: Abacavir
Entry
D07057                      Drug                                   
Name
Abacavir (INN)
Formula
C14H18N6O
Exact mass
286.1542
Mol weight
286.3323
Structure
Simcomp
Class
Antiviral
 DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
 DG03107  Anti-HIV agent
  DG01656  HIV reverse transcriptase inhibitor
Remark
Same as: C07624
ATC code: J05AF06
Chemical structure group: DG00660
Product (DG00660): D00891<JP/US>
Product (mixture): D10838<US>
Efficacy
Antiviral, Reverse transcriptase inhibitor
Target
HIV-1 reverse transcriptase [KO:K24802]
Interaction
Structure map
map07044  Antiviral agents
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
     J05AF06 Abacavir
      D07057  Abacavir (INN)
Drug groups [BR:br08330]
 Antiviral
  DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
   DG00660  Abacavir
    D07057  Abacavir
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    DG00660  Abacavir
     D07057  Abacavir
Antimicrobials [BR:br08307]
 Antivirals
  Genome replication inhibitor
   HIV reverse transcriptase inhibitor
    D07057  Abacavir (INN)
Drug groups [BR:br08330]
 Antiviral
  DG01890  Nucleoside reverse transcriptase inhibitor (NRTI)
   DG00660  Abacavir
  DG03107  Anti-HIV agent
   DG01656  HIV reverse transcriptase inhibitor
    DG00660  Abacavir
Antimicrobials abbreviations [BR:br08327]
 Antivirals
  Genome replication inhibitor
   HIV reverse transcriptase inhibitor
    DG00660  Abacavir
Other DBs
CAS: 136470-78-5
PubChem: 51091399
ChEBI: 421707
PDB-CCD: 1KX[PDBj]
LigandBox: D07057
LinkDB
KCF data

ATOM        21
            1   C8y C    23.8170  -14.6900
            2   C8y C    23.7804  -16.2205
            3   C8y C    25.0169  -14.0352
            4   N5x N    22.6209  -14.2394
            5   N4y N    22.5468  -16.6128
            6   N5x N    24.9874  -16.9825
            7   N1b N    24.9742  -12.6601
            8   N5x N    26.2927  -14.8134
            9   C8x C    21.7300  -15.3835
            10  C1y C    21.3918  -17.5530
            11  C8y C    26.3325  -16.2972
            12  C1y C    26.2749  -11.9849
            13  C1x C    20.2274  -16.7385
            14  C2x C    21.0014  -18.8162
            15  N1a N    27.4571  -17.0274
            16  C1x C    27.6665  -12.0101
            17  C1x C    26.9828  -10.7806
            18  C1y C    19.1513  -17.5594
            19  C2x C    19.6159  -18.8564
            20  C1b C    17.8359  -17.1879
            21  O1a O    16.7496  -18.0561
BOND        24
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 2
            9    10   5 1 #Up
            10    6  11 2
            11    7  12 1
            12   10  13 1
            13   10  14 1
            14   11  15 1
            15   12  16 1
            16   12  17 1
            17   13  18 1
            18   14  19 2
            19   18  20 1 #Up
            20   20  21 1
            21    5   9 1
            22    8  11 1
            23   16  17 1
            24   18  19 1

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