KEGG   DRUG: Thiphencillin potassium
Entry
D06113                      Drug                                   
Name
Thiphencillin potassium (USAN)
Formula
C16H17N2O4S2. K
Exact mass
404.0267
Mol weight
404.55
Structure
Simcomp
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01713  Penicillin skeleton group
   DG01480  Penicillin
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Comment
beta-Lactam, penicillin
Interaction
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     D06113  Thiphencillin potassium
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Other penicillin
    D06113  Thiphencillin potassium (USAN)
Other DBs
CAS: 4803-45-6
PubChem: 47207771
LigandBox: D06113
NIKKAJI: J8.777G
LinkDB
KCF data

ATOM        25
            1   C1y C    14.2907  -15.2716
            2   C5x C    14.2907  -16.6745
            3   N1y N    15.6937  -16.6745
            4   C1y C    15.6937  -15.2716
            5   C1y C    17.0263  -17.0953
            6   C1z C    17.8679  -15.9729
            7   S2x S    17.0263  -14.8506
            8   C1a C    18.8501  -16.9549
            9   C1a C    18.8501  -14.9909
            10  C6a C    17.5173  -18.4279
            11  O6a O    18.9200  -18.4279 #-
            12  O6a O    16.6754  -19.5502
            13  N1b N    13.0983  -14.5701
            14  C5a C    11.9058  -15.2716
            15  O5x O    13.0983  -17.3758
            16  O5a O    11.9058  -16.6745
            17  C1b C    10.6881  -14.5750
            18  S2a S     9.4973  -15.2693
            19  C8y C     8.2855  -14.5696
            20  C8x C     8.2852  -13.1421
            21  C8x C     7.0743  -12.4433
            22  C8x C     5.8638  -13.1425
            23  C8x C     5.8640  -14.5701
            24  C8x C     7.0748  -15.2688
            25  Z   K    20.3922  -18.4546 #+
BOND        26
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     3   5 1
            6     5   6 1
            7     6   7 1
            8     4   7 1
            9     6   8 1
            10    6   9 1
            11    5  10 1 #Down
            12   10  11 1
            13   10  12 2
            14    1  13 1 #Up
            15   13  14 1
            16    2  15 2
            17   14  16 2
            18   14  17 1
            19   17  18 1
            20   18  19 1
            21   19  20 2
            22   20  21 1
            23   21  22 2
            24   22  23 1
            25   23  24 2
            26   19  24 1

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