KEGG   DRUG: Methacycline hydrochloride
Entry
D00849                      Drug                                   

Name
Methacycline hydrochloride (JAN/USP);
MTC;
Rondomycin (TN)
Formula
C22H22N2O8. HCl
Exact mass
478.1143
Mol weight
478.8796
Structure
Simcomp
Class
Antibacterial
 DG01197  Tetracycline antibiotic
Remark
Same as: C08029
ATC code: J01AA05
Chemical structure group: DG00514
Efficacy
Antibacterial, Protein biosynthesis inhibitor
Target
30S ribosomal subunit
  Pathway
ko03010  Ribosome
Interaction
Structure map
map07019  Tetracyclines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01A TETRACYCLINES
    J01AA Tetracyclines
     J01AA05 Metacycline
      D00849  Methacycline hydrochloride (JAN/USP)
Other DBs
CAS: 3963-95-9
PubChem: 7847914
ChEBI: 6806
ChEMBL: CHEMBL2146123
LigandBox: D00849
NIKKAJI: J219.963G
LinkDB
KCF data

ATOM        33
            1   X   Cl   40.2039  -17.3526
            2   C8x C    25.2700  -17.1500
            3   C8x C    25.2700  -18.5500
            4   C8y C    26.4600  -19.2500
            5   C8y C    27.7200  -18.5500
            6   C8y C    27.7200  -17.1500
            7   C8x C    26.4600  -16.4500
            8   C5x C    28.9100  -19.2500
            9   C2y C    30.1000  -18.5500
            10  C1y C    30.1000  -17.1500
            11  C2y C    28.9100  -16.4500
            12  C2y C    31.3600  -19.2500
            13  C1z C    32.5500  -18.5500
            14  C1y C    32.5500  -17.1500
            15  C1y C    31.3600  -16.4500
            16  C5x C    33.7400  -19.2500
            17  C2y C    35.0000  -18.5500
            18  C2y C    35.0000  -17.1500
            19  C1y C    33.7400  -16.4500
            20  C2a C    28.9100  -15.0500
            21  O5x O    28.9100  -20.6500
            22  O5x O    33.7400  -20.6500
            23  O1a O    26.4600  -20.6500
            24  O1a O    31.3600  -20.6500
            25  C5a C    36.1900  -19.2500
            26  N1a N    37.3800  -18.5500
            27  O5a O    36.1900  -20.6500
            28  O1a O    36.1900  -16.4500
            29  O1a O    31.3600  -14.8400
            30  N1c N    33.7400  -14.2800
            31  O1a O    32.5500  -19.9500
            32  C1a C    34.9300  -13.5800
            33  C1a C    32.5500  -13.5800
BOND        35
            1     2   3 2
            2     3   4 1
            3     4   5 2
            4     5   6 1
            5     6   7 2
            6     2   7 1
            7     5   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11    6  11 1
            12    9  12 2
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   10  15 1
            17   13  16 1
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   14  19 1
            22   11  20 2
            23    8  21 2
            24   16  22 2
            25    4  23 1
            26   12  24 1
            27   17  25 1
            28   25  26 1
            29   25  27 2
            30   18  28 1
            31   15  29 1 #Down
            32   19  30 1 #Down
            33   13  31 1 #Down
            34   30  32 1
            35   30  33 1

» Japanese version   » Back

KEGG   DRUG: Methacycline
Entry
D04972                      Drug                                   

Name
Methacycline (USAN);
Metacycline (INN)
Formula
C22H22N2O8
Exact mass
442.1376
Mol weight
442.4187
Structure
Simcomp
Class
Antibacterial
 DG01197  Tetracycline antibiotic
Remark
Same as: C07654
ATC code: J01AA05
Chemical structure group: DG00514
Efficacy
Antibacterial, Protein biosynthesis inhibitor
Target
30S ribosomal subunit
  Pathway
ko03010  Ribosome
Interaction
Structure map
map07019  Tetracyclines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01A TETRACYCLINES
    J01AA Tetracyclines
     J01AA05 Metacycline
      D04972  Methacycline (USAN)
Other DBs
CAS: 914-00-1
PubChem: 47206705
ChEBI: 6805
ChEMBL: CHEMBL249837
DrugBank: DB00931
LigandBox: D04972
NIKKAJI: J7.166H
LinkDB
KCF data

ATOM        32
            1   C8x C    11.1300   -9.3800
            2   C8x C    11.1300  -10.7800
            3   C8y C    12.3424  -11.4800
            4   C8y C    13.5549  -10.7800
            5   C8y C    13.5549   -9.3800
            6   C8x C    12.3424   -8.6800
            7   C5x C    14.7673  -11.4800
            8   C2y C    15.9797  -10.7800
            9   C1y C    15.9797   -9.3800
            10  C2y C    14.7673   -8.6800
            11  C2y C    17.1922  -11.4800
            12  C1z C    18.4046  -10.7800
            13  C1y C    18.4046   -9.3800
            14  C1y C    17.1922   -8.6800
            15  C5x C    19.6170  -11.4800
            16  C2y C    20.8295  -10.7800
            17  C2y C    20.8295   -9.3800
            18  C1y C    19.6170   -8.6800
            19  C2a C    14.7673   -7.2800
            20  O5x O    14.7673  -12.8800
            21  O5x O    19.6170  -12.8799
            22  O1a O    12.3424  -12.8798
            23  O1a O    17.1922  -12.8797
            24  C5a C    22.0646  -11.4934
            25  N1a N    23.2719  -10.7966
            26  O5a O    22.0642  -12.8799
            27  O1a O    22.0646   -8.6666
            28  O1a O    17.1922   -7.0703
            29  N1c N    19.6170   -6.5100
            30  O1a O    18.4046  -12.1800
            31  C1a C    20.8166   -5.8173
            32  C1a C    18.3919   -5.8026
BOND        35
            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 1
            10    9  10 1
            11    5  10 1
            12    8  11 2
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 1
            17   12  15 1
            18   15  16 1
            19   16  17 2
            20   17  18 1
            21   13  18 1
            22   10  19 2
            23    7  20 2
            24   15  21 2
            25    3  22 1
            26   11  23 1
            27   16  24 1
            28   24  25 1
            29   24  26 2
            30   17  27 1
            31   14  28 1 #Down
            32   18  29 1 #Down
            33   12  30 1 #Down
            34   29  31 1
            35   29  32 1

» Japanese version   » Back

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