KEGG   DRUG: Trimethoprim hydrochloride
Entry
D11085                      Drug                                   
Name
Trimethoprim hydrochloride;
Primsol (TN);
Trimpex (TN)
Formula
C14H18N4O3. HCl
Exact mass
326.1146
Mol weight
326.7787
Structure
Simcomp
Class
Antibacterial
 DG01581  Trimethoprim antibacterial
Metabolizing enzyme inhibitor
 DG01641  CYP2C8 inhibitor
Remark
ATC code: J01EA01
Chemical structure group: DG00595
Product (DG00595): D00145<US>
Product (mixture): D11086<US>
Efficacy
Antibacterial, Folic acid biosynthesis inhibitor
  Disease
Uncomplicated urinary tract infections [DS:H01176]
Target
dihydrofolate reductase [KO:K13938]
  Pathway
ko00670  One carbon pool by folate
ko00790  Folate biosynthesis
Interaction
CYP inhibition: CYP2C8 [HSA:1558]
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01E SULFONAMIDES AND TRIMETHOPRIM
    J01EA Trimethoprim and derivatives
     J01EA01 Trimethoprim
      D11085  Trimethoprim hydrochloride
Drug groups [BR:br08330]
 Antibacterial
  DG01581  Trimethoprim antibacterial
   DG00595  Trimethoprim
    D11085  Trimethoprim hydrochloride
 Metabolizing enzyme inhibitor
  DG01641  CYP2C8 inhibitor
   DG00595  Trimethoprim
    D11085  Trimethoprim hydrochloride
Antimicrobials [BR:br08307]
 Antibacterials
  Folic acid biosynthesis inhibitor
   Trimethoprim
    D11085  Trimethoprim hydrochloride
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D11085
Drug groups [BR:br08330]
 Antibacterial
  DG01581  Trimethoprim antibacterial
   DG00595  Trimethoprim
 Metabolizing enzyme inhibitor
  DG01641  CYP2C8 inhibitor
   DG00595  Trimethoprim
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Folic acid biosynthesis inhibitor
   Trimethoprim
    DG00595  Trimethoprim
Other DBs
CAS: 60834-30-2
PubChem: 375581032
LinkDB
KCF data

ATOM        22
            1   C8y C    18.0338  -17.1983
            2   C1b C    19.2174  -17.8945
            3   C8x C    16.8501  -17.8945
            4   C8x C    18.0338  -15.8057
            5   C8y C    20.4011  -17.1983
            6   C8y C    15.5968  -17.1983
            7   C8y C    16.8501  -15.1094
            8   C8y C    21.6544  -17.8945
            9   C8x C    20.4011  -15.7361
            10  C8y C    15.5968  -15.8057
            11  O2a O    14.4132  -17.8945
            12  O2a O    16.8501  -13.7169
            13  N5x N    22.8381  -17.1983
            14  N1a N    21.6544  -19.2871
            15  N5x N    21.6544  -15.0398
            16  O2a O    14.4132  -15.1791
            17  C1a C    13.2295  -17.1286
            18  C1a C    18.0338  -13.0206
            19  C8y C    22.8381  -15.7361
            20  C1a C    14.4132  -13.7169
            21  N1a N    24.0217  -15.0398
            22  X   Cl   26.2500  -19.1800
BOND        22
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     3   6 2
            6     4   7 1
            7     5   8 2
            8     5   9 1
            9     6  10 1
            10    6  11 1
            11    7  12 1
            12    8  13 1
            13    8  14 1
            14    9  15 2
            15   10  16 1
            16   11  17 1
            17   12  18 1
            18   13  19 2
            19   16  20 1
            20   19  21 1
            21    7  10 2
            22   15  19 1

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