KEGG   DRUG: D03680Help
Entry
D03680                      Drug                                   

Name
Demethylchlortetracycline (JAN);
Demeclocycline (USP);
DMCTC
Formula
C21H21ClN2O8
Exact mass
464.0986
Mol weight
464.853
Structure
Mol fileKCF fileDB searchJmolKegDraw
Source
Streptomyces aureofaciens [TAX:1894]
Activity
Antibacterial
Remark
ATC code: 
Drug group: 
Comment
Natural product
Target
16S rRNA of 30S ribosomal subunit, protein synthesis inhibitor [KO:K01977]
  Pathway
ko03010  Ribosome  
 
Interaction
Drug interaction
Structure map
Tetracyclines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 D DERMATOLOGICALS
  D06 ANTIBIOTICS AND CHEMOTHERAPEUTICS FOR DERMATOLOGICAL USE
   D06A ANTIBIOTICS FOR TOPICAL USE
    D06AA Tetracycline and derivatives
     D06AA01 Demeclocycline
      D03680  Demethylchlortetracycline (JAN); Demeclocycline (USP)
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01A TETRACYCLINES
    J01AA Tetracyclines
     J01AA01 Demeclocycline
      D03680  Demethylchlortetracycline (JAN); Demeclocycline (USP)
USP drug classification [BR:br08302]
 Antibacterials
  Tetracyclines
   Demeclocycline
    D03680  Demethylchlortetracycline (JAN); Demeclocycline (USP)
Risk category of Japanese OTC drugs [BR:br08312]
 Second-class OTC drugs
  Inorganic and organic chemicals
   Demethylchlortetracycline
    D03680  Demethylchlortetracycline (JAN); Demeclocycline (USP)
Antiinfectives [BR:br08307]
 Antibacterials
  Protein biosynthesis inhibitor
   16S rRNA of 30S ribosomal subunit inhibitor
    Tetracyclines
     Demeclocycline
      D03680  Demethylchlortetracycline (JAN); Demeclocycline (USP)
BRITE hierarchy
Other DBs
CAS: 
127-33-3
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        32
            1   C1y C    35.2619  -18.2923
            2   C1z C    35.2503  -19.6742
            3   C1y C    36.4630  -17.6043
            4   C1x C    34.0550  -17.5927
            5   C2y C    34.0550  -20.3739
            6   C5x C    36.4455  -20.3739
            7   O1a O    35.2503  -21.0676
            8   C2y C    37.6582  -18.3040
            9   N1c N    36.4689  -16.2050
            10  C1y C    32.8481  -18.2923
            11  C2y C    32.8481  -19.6859
            12  O1a O    34.0609  -21.7790
            13  C2y C    37.6524  -19.6917
            14  O5x O    36.4398  -21.7731
            15  O1a O    38.8710  -17.6103
            16  C1a C    37.6875  -15.5113
            17  C1a C    35.2619  -15.4996
            18  C1y C    31.6355  -17.5927
            19  C5x C    31.6472  -20.3913
            20  C5a C    38.8535  -20.3913
            21  C8y C    30.4286  -18.3040
            22  O1a O    31.6355  -16.1234
            23  C8y C    30.4344  -19.6976
            24  O5x O    31.6590  -21.7906
            25  N1a N    40.0720  -19.7033
            26  O5a O    38.8477  -21.7963
            27  C8y C    29.2158  -17.6043
            28  C8y C    29.2333  -20.4030
            29  C8x C    28.0030  -18.3157
            30  X   Cl   29.2100  -16.1992
            31  C8x C    28.0147  -19.7149
            32  O1a O    29.2450  -21.8080
BOND        35
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1 #Down
            7     3   8 1
            8     3   9 1 #Down
            9     4  10 1
            10    5  11 2
            11    5  12 1
            12    6  13 1
            13    6  14 2
            14    8  15 1
            15    9  16 1
            16    9  17 1
            17   10  18 1
            18   11  19 1
            19   13  20 1
            20   18  21 1
            21   18  22 1 #Up
            22   19  23 1
            23   19  24 2
            24   20  25 1
            25   20  26 2
            26   21  27 1
            27   23  28 1
            28   27  29 2
            29   27  30 1
            30   28  31 2
            31   28  32 1
            32    8  13 2
            33   10  11 1
            34   21  23 2
            35   29  31 1

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