KEGG   DRUG: Sulfamonomethoxine
Entry
D01141                      Drug                                   
Name
Sulfamonomethoxine (JAN/USAN/INN);
Daimeton (TN)
Formula
C11H12N4O3S
Exact mass
280.063
Mol weight
280.303
Structure
Simcomp
Class
Antibacterial
 DG01787  Sulfonamide antibacterial
  DG01786  Long-acting sulfonamide
Remark
Same as: C12540
Chemical structure group: DG01204
Efficacy
Antibacterial, Folic acid biosynthesis inhibitor
Comment
Sulfonamide
Target
dihydropteroate synthase [KO:K00796]
  Pathway
ko00790  Folate biosynthesis
Interaction
Structure map
map07016  Sulfonamide derivatives - sulfa drugs
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
     D01141  Sulfamonomethoxine
Antimicrobials [BR:br08307]
 Antibacterials
  Folic acid biosynthesis inhibitor
   Long-acting sulfonamide
    D01141  Sulfamonomethoxine (JAN/USAN/INN)
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
Other DBs
CAS: 1220-83-3
PubChem: 7848204
ChEBI: 32164
PDB-CCD: K4Y[PDBj]
LigandBox: D01141
NIKKAJI: J4.537C
LinkDB
KCF data

ATOM        19
            1   C8x C    13.7900  -16.5200
            2   C8y C    13.7900  -17.9200
            3   C8x C    15.0500  -18.6200
            4   C8x C    16.2400  -17.9200
            5   C8y C    16.2400  -16.5200
            6   C8x C    15.0500  -15.8200
            7   N1a N    12.6000  -18.6200
            8   S4a S    17.4300  -15.8200
            9   N1b N    18.6200  -16.5200
            10  C8y C    19.8800  -15.8200
            11  C8x C    21.0700  -16.5200
            12  C8y C    22.2600  -15.8200
            13  N5x N    22.2600  -14.4200
            14  C8x C    21.0700  -13.7200
            15  N5x N    19.8800  -14.4200
            16  O2a O    23.5200  -16.5200
            17  O3c O    18.4100  -14.8400
            18  O3c O    16.4500  -14.8400
            19  C1a C    24.7100  -15.8200
BOND        20
            1     3   4 2
            2     9  10 1
            3     4   5 1
            4     5   6 2
            5     6   1 1
            6     2   7 1
            7    10  11 2
            8    11  12 1
            9    12  13 2
            10   13  14 1
            11   14  15 2
            12   15  10 1
            13    1   2 2
            14   12  16 1
            15    5   8 1
            16    8  17 2
            17    2   3 1
            18    8  18 2
            19    8   9 1
            20   16  19 1

» Japanese version   » Back

KEGG   DRUG: Sulfamonomethoxine sodium
Entry
D02001                      Drug                                   
Name
Sulfamonomethoxine sodium (JAN);
Sulfamonomethoxine sodium monohydrate
Formula
C11H11N4O3S. Na. H2O
Exact mass
320.0555
Mol weight
320.3001
Structure
Simcomp
Class
Antibacterial
 DG01787  Sulfonamide antibacterial
  DG01786  Long-acting sulfonamide
Remark
Chemical structure group: DG01204
Efficacy
Antibacterial, Folic acid biosynthesis inhibitor
Comment
Sulfonamide
Target
dihydropteroate synthase [KO:K00796]
  Pathway
ko00790  Folate biosynthesis
Interaction
Structure map
map07016  Sulfonamide derivatives - sulfa drugs
Brite
Animal drugs in Japan [BR:br08331]
 97  Agents against pathogenic micro-organisms and parasites (except biological products and disinfectants)
  971  Sulfonamide preparations
   9712  Sulfonamide preparations for peroral and feed additive use
    D02001  Sulfamonomethoxine sodium
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
     D02001  Sulfamonomethoxine sodium
Antimicrobials [BR:br08307]
 Antibacterials
  Folic acid biosynthesis inhibitor
   Long-acting sulfonamide
    D02001  Sulfamonomethoxine sodium (JAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
Other DBs
PubChem: 7849063
LigandBox: D02001
LinkDB
KCF data

ATOM        21
            1   C8x C    12.3900  -16.5200
            2   C8y C    12.3900  -17.9200
            3   C8x C    13.5800  -18.6200
            4   C8x C    14.8400  -17.9200
            5   C8y C    14.8400  -16.5200
            6   C8x C    13.5800  -15.8200
            7   N1a N    11.2000  -18.6200
            8   S4a S    16.0300  -15.8200
            9   N1b N    17.2200  -16.5200 #-
            10  C8y C    18.4800  -15.8200
            11  C8x C    19.6700  -16.5200
            12  C8y C    20.8600  -15.8200
            13  N5x N    20.8600  -14.4200
            14  C8x C    19.6700  -13.7200
            15  N5x N    18.4800  -14.4200
            16  O2a O    22.0500  -16.5200
            17  O3c O    17.0100  -14.8400
            18  O3c O    14.9800  -14.8400
            19  C1a C    23.3100  -15.8200
            20  Z   Na   17.6400  -18.4800 #+
            21  O0  O    26.8800  -15.8900
BOND        20
            1     3   4 2
            2     9  10 1
            3     4   5 1
            4     5   6 2
            5     6   1 1
            6     2   7 1
            7    10  11 2
            8    11  12 1
            9    12  13 2
            10   13  14 1
            11   14  15 2
            12   15  10 1
            13    1   2 2
            14   12  16 1
            15    5   8 1
            16    8  17 2
            17    2   3 1
            18    8  18 2
            19    8   9 1
            20   16  19 1

» Japanese version   » Back

KEGG   DRUG: Sulfamonomethoxine hydrate
Entry
D05023                      Drug                                   
Name
Sulfamonomethoxine hydrate (JP18);
Daimeton (TN)
Formula
C11H12N4O3S. H2O
Exact mass
298.0736
Mol weight
298.3183
Structure
Simcomp
Class
Antibacterial
 DG01787  Sulfonamide antibacterial
  DG01786  Long-acting sulfonamide
Remark
Chemical structure group: DG01204
Efficacy
Antibacterial, Folic acid biosynthesis inhibitor
Comment
Sulfonamide
Target
dihydropteroate synthase [KO:K00796]
  Pathway
ko00790  Folate biosynthesis
Interaction
Structure map
map07016  Sulfonamide derivatives - sulfa drugs
Brite
Animal drugs in Japan [BR:br08331]
 97  Agents against pathogenic micro-organisms and parasites (except biological products and disinfectants)
  971  Sulfonamide preparations
   9712  Sulfonamide preparations for peroral and feed additive use
    D05023  Sulfamonomethoxine hydrate
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
     D05023  Sulfamonomethoxine hydrate
Antimicrobials [BR:br08307]
 Antibacterials
  Folic acid biosynthesis inhibitor
   Long-acting sulfonamide
    D05023  Sulfamonomethoxine hydrate (JP18)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D05023  Sulfamonomethoxine hydrate
Drug groups [BR:br08330]
 Antibacterial
  DG01787  Sulfonamide antibacterial
   DG01786  Long-acting sulfonamide
    DG01204  Sulfamonomethoxine
Other DBs
PubChem: 47206750
LigandBox: D05023
LinkDB
KCF data

ATOM        20
            1   C8x C    13.1600  -16.5200
            2   C8y C    13.1600  -17.9900
            3   C8x C    14.4200  -18.6900
            4   C8x C    15.6100  -17.9900
            5   C8y C    15.6100  -16.5200
            6   C8x C    14.4200  -15.8200
            7   N1a N    11.9700  -18.6900
            8   S4a S    16.8000  -15.8200
            9   N1b N    17.9900  -16.5200
            10  C8y C    19.2500  -15.8200
            11  C8x C    20.4400  -16.5200
            12  C8y C    21.6300  -15.8200
            13  N5x N    21.6300  -14.4200
            14  C8x C    20.4400  -13.7200
            15  N5x N    19.2500  -14.4200
            16  O2a O    22.9600  -16.5200
            17  O3c O    17.7800  -14.8400
            18  O3c O    15.8200  -14.8400
            19  C1a C    24.1500  -15.8200
            20  O0  O    25.3400  -18.9000
BOND        20
            1     3   4 2
            2     9  10 1
            3     4   5 1
            4     5   6 2
            5     6   1 1
            6     2   7 1
            7    10  11 2
            8    11  12 1
            9    12  13 2
            10   13  14 1
            11   14  15 2
            12   15  10 1
            13    1   2 2
            14   12  16 1
            15    5   8 1
            16    8  17 2
            17    2   3 1
            18    8  18 2
            19    8   9 1
            20   16  19 1

» Japanese version   » Back

DBGET integrated database retrieval system