KEGG   DRUG: Doripenem
Entry
D03895                      Drug                                   
Name
Doripenem (USAN/INN)
Formula
C15H24N4O6S2
Exact mass
420.1137
Mol weight
420.5043
Structure
Simcomp
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01713  Penicillin skeleton group
   DG01458  Carbapenem
Remark
ATC code: J01DH04
Chemical structure group: DG00593
Product (DG00593): D01836<JP>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01D OTHER BETA-LACTAM ANTIBACTERIALS
    J01DH Carbapenems
     J01DH04 Doripenem
      D03895  Doripenem (USAN/INN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01458  Carbapenem
     DG00593  Doripenem
      D03895  Doripenem
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Carbapenem
    D03895  Doripenem (USAN/INN)
New drug approvals in the USA [br08319.html]
 New molecular entities and new therapeutic biological products
  D03895
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D03895
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01458  Carbapenem
     DG00593  Doripenem
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Carbapenem
    DG00593  Doripenem
Other DBs
CAS: 148016-81-3
PubChem: 17397979
PDB-CCD: O6P[PDBj]
LigandBox: D03895
NIKKAJI: J1.864.558K
KCF data

ATOM        27
            1   C1y C    28.4174  -15.7403
            2   C1y C    22.0226  -13.8425
            3   C5x C    22.0226  -15.2120
            4   N1y N    23.3237  -15.2120
            5   C1y C    23.3237  -13.8425
            6   C2y C    24.6248  -15.6229
            7   C2y C    25.4466  -14.5272
            8   C1y C    24.6248  -13.4316
            9   C6a C    25.0357  -16.9240
            10  O6a O    26.4053  -16.9240
            11  O6a O    24.2824  -18.0197
            12  S2a S    27.7171  -14.5272
            13  C1a C    25.0435  -12.1276
            14  C1c C    20.8010  -13.1371
            15  C1a C    19.5793  -13.8425
            16  O5x O    20.8010  -15.9174
            17  O1a O    20.8013  -11.7109
            18  C1x C    28.0045  -17.0869
            19  N1x N    29.1576  -17.8945
            20  C1y C    30.2820  -17.0475
            21  C1x C    29.8238  -15.7163
            22  C1b C    31.6820  -17.0475
            23  N1b N    32.3751  -15.8481
            24  S4a S    33.8097  -15.8493
            25  N1a N    35.2097  -15.8493
            26  O3c O    33.8091  -17.2200
            27  O3c O    33.8103  -14.4200
BOND        29
            1     2   3 1
            2     3   4 1
            3     4   5 1
            4     2   5 1
            5     4   6 1
            6     6   7 2
            7     7   8 1
            8     5   8 1
            9     6   9 1
            10    9  10 1
            11    9  11 2
            12    7  12 1
            13    8  13 1 #Up
            14    2  14 1
            15   14  15 1
            16    3  16 2
            17   14  17 1 #Up
            18    1  12 1 #Up
            19    1  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23    1  21 1
            24   22  23 1
            25   23  24 1
            26   20  22 1 #Up
            27   24  25 1
            28   24  26 2
            29   24  27 2

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