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KEGG   DRUG: Ledaborbactam etzadroxil
Entry
D12472                      Drug                                   
Name
Ledaborbactam etzadroxil (USAN/INN)
Formula
C19H26BNO7
Exact mass
391.1802
Mol weight
391.22
Structure
Class
Antibacterial
 DG01479  beta-Lactamase inhibitor
Remark
Chemical structure group: DG03246
Efficacy
Antibacterial, beta-Lactamase inhibitor
Comment
Treatment of infections
Target
beta-lactamases
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01479  beta-Lactamase inhibitor
   DG03246  Ledaborbactam
    D12472  Ledaborbactam etzadroxil
Drug groups [BR:br08330]
 Antibacterial
  DG01479  beta-Lactamase inhibitor
   DG03246  Ledaborbactam
Other DBs
CAS: 1842399-68-1
PubChem: 497620885
KCF data

ATOM        28
            1   C8x C    13.8000  -16.3090
            2   C8x C    13.8000  -17.7726
            3   C8x C    15.0545  -18.4696
            4   C8y C    16.2393  -17.7726
            5   C8y C    16.2393  -16.3090
            6   C8y C    15.0545  -15.6121
            7   C1x C    17.4938  -18.4696
            8   C1y C    18.6787  -17.7726
            9   Z   B    18.6787  -16.3090
            10  O2x O    17.4938  -15.6121
            11  C7a C    15.0545  -14.2182
            12  O6a O    16.2393  -13.5212
            13  O1a O    19.8635  -15.6818
            14  N1b N    19.8635  -18.3999
            15  C5a C    21.0483  -17.7726
            16  C1b C    22.2331  -18.3999
            17  C1a C    23.4179  -17.7726
            18  O5a O    21.0483  -16.3090
            19  O7a O    13.8323  -13.5192
            20  C1b C    12.6475  -14.2098
            21  O7a O    11.4493  -13.5245
            22  C7a C    10.2690  -14.2125
            23  C1c C     9.0686  -13.5258
            24  O6a O    10.2747  -15.6099
            25  C1b C     7.8893  -14.2130
            26  C1a C     6.6885  -13.5260
            27  C1b C     9.0686  -12.1258
            28  C1a C     7.8733  -11.4353
BOND        29
            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    6  11 1
            13   11  12 2
            14    9  13 1
            15    8  14 1 #Up
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   15  18 2
            20   11  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   22  24 2
            26   23  25 1
            27   25  26 1
            28   23  27 1
            29   27  28 1

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