KEGG   DRUG: PirlimycinHelp
Entry
D08391                      Drug                                   

Name
Pirlimycin (INN);
Pirsue [veterinary] (TN)
Formula
C17H31ClN2O5S
Exact mass
410.1642
Mol weight
410.9564
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01578  Lincosamide antibiotic
Remark
Chemical structure group: DG01577
Efficacy
Antibacterial, Protein biosynthesis inhibitor
Comment
Lincosamide
Target
50S ribosomal subunit
  Pathway
ko03010  Ribosome
Other DBs
CAS: 79548-73-5
PubChem: 96025077
ChEMBL: CHEMBL1652611
LigandBox: D08391
NIKKAJI: J32.482E
LinkDB All DBs
KCF data Show

ATOM        26
            1   C1y C    27.1600  -17.5700
            2   C1y C    27.1600  -18.9700
            3   C1y C    28.4900  -19.6700
            4   C1y C    29.6800  -18.9700
            5   C1y C    29.6800  -17.5700
            6   O2x O    28.4900  -16.8700
            7   S2a S    30.8700  -16.8700
            8   C1a C    30.8700  -15.4700
            9   O1a O    30.8700  -19.6700
            10  O1a O    28.4900  -21.0700
            11  O1a O    25.9700  -19.6700
            12  C1c C    25.9700  -16.8700
            13  N1b N    24.7800  -17.5700
            14  C1c C    25.9700  -15.4700
            15  C1a C    27.1600  -14.7700
            16  C5a C    23.5900  -16.8700
            17  C1y C    22.3300  -17.5700
            18  O5a O    23.5900  -15.4700
            19  X   Cl   24.7800  -14.7700
            20  C1x C    21.1400  -16.8700
            21  C1y C    19.9500  -17.5700
            22  C1x C    19.9500  -18.9700
            23  C1x C    21.1400  -19.6700
            24  N1x N    22.3300  -18.9700
            25  C1b C    18.6900  -16.8700
            26  C1a C    17.5000  -17.5700
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1 #Down
            8     7   8 1
            9     4   9 1 #Down
            10    3  10 1 #Up
            11    2  11 1 #Up
            12    1  12 1
            13   12  13 1
            14   12  14 1
            15   14  15 1
            16   13  16 1
            17   17  16 1
            18   16  18 2
            19   14  19 1 #Up
            20   17  20 1
            21   20  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   17  24 1
            26   21  25 1 #Up
            27   25  26 1

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