KEGG   DRUG: OmadacyclineHelp
Entry
D09647                      Drug                                   

Name
Omadacycline (USAN)
Product
Formula
C29H40N4O7
Exact mass
556.2897
Mol weight
556.6505
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01197  Tetracycline antibiotic
Remark
Chemical structure group: DG01198
Product (DG01198): D09647<US>
Efficacy
Antibiotic, Protein biosynthesis inhibitor
Target
30S ribosomal subunit
  Pathway
ko03010  Ribosome
Interaction
Drug interaction
Other DBs
CAS: 389139-89-3
PubChem: 124490387
ChEMBL: CHEMBL1689772
LigandBox: D09647
LinkDB All DBs
KCF data Show

ATOM        40
            1   C8y C    20.6041  -26.9368
            2   C8x C    20.6041  -25.5337
            3   C8y C    21.7966  -24.8322
            4   C8y C    23.0594  -25.5337
            5   C8y C    23.0594  -26.9368
            6   C8y C    21.7966  -27.6383
            7   C1x C    24.2520  -24.8322
            8   C1y C    25.4446  -25.5337
            9   C2y C    25.4446  -26.9368
            10  C5x C    24.2520  -27.6383
            11  C1x C    26.7073  -24.8322
            12  C1y C    27.8999  -25.5337
            13  C1z C    27.8999  -26.9368
            14  C2y C    26.7073  -27.6383
            15  C1y C    29.0925  -24.8322
            16  C2y C    30.3552  -25.5337
            17  C2y C    30.3552  -26.9368
            18  C5x C    29.0925  -27.6383
            19  C1b C    19.4115  -27.6383
            20  N1b N    18.2189  -26.9368
            21  C1b C    17.0263  -27.6383
            22  C1d C    15.8337  -26.9368
            23  C1a C    14.6411  -27.6383
            24  C1a C    15.8337  -25.5337
            25  C1a C    14.5710  -26.2353
            26  O5x O    24.2520  -29.0414
            27  O1a O    26.7073  -29.0414
            28  O1a O    21.7966  -29.0414
            29  O5x O    29.0925  -29.0414
            30  O1a O    27.8999  -28.3398
            31  N1c N    29.0925  -23.4292
            32  C5a C    31.5478  -27.6383
            33  N1a N    32.7404  -26.9368
            34  O5a O    31.5478  -29.0414
            35  N1c N    21.7966  -23.4292
            36  C1a C    20.6041  -22.7277
            37  C1a C    22.9892  -22.7277
            38  O1a O    31.5478  -24.8322
            39  C1a C    27.8999  -22.7277
            40  C1a C    30.2851  -22.7277
BOND        43
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16    9  14 2
            17   12  15 1
            18   15  16 1
            19   16  17 2
            20   17  18 1
            21   13  18 1
            22    1  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   22  23 1
            27   22  24 1
            28   22  25 1
            29   10  26 2
            30   14  27 1
            31    6  28 1
            32   18  29 2
            33   13  30 1 #Down
            34   15  31 1 #Down
            35   17  32 1
            36   32  33 1
            37   32  34 2
            38    3  35 1
            39   35  36 1
            40   35  37 1
            41   16  38 1
            42   31  39 1
            43   31  40 1

» Japanese version   » Back

DBGET integrated database retrieval system