KEGG   DRUG: Apalcillin sodium
Entry
D02415                      Drug                                   
Name
Apalcillin sodium (USAN)
Formula
C25H22N5O6S. Na
Exact mass
543.1188
Mol weight
543.53
Structure
Class
Antibacterial
 DG01710  beta-Lactam antibiotic
  DG01713  Penicillin skeleton group
   DG01480  Penicillin
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Comment
beta-Lactam, penicillin
Target
penicillin binding protein
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Brite
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     D02415  Apalcillin sodium
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Other penicillin
    D02415  Apalcillin sodium (USAN)
Antimicrobials abbreviations [BR:br08327]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Other penicillin
    D02415  Apalcillin sodium (USAN)
Other DBs
CAS: 58795-03-2
PubChem: 7849473
ChEBI: 51697
LigandBox: D02415
NIKKAJI: J28.633H
LinkDB
KCF data

ATOM        38
            1   C1y C    31.6400  -15.1200
            2   C5x C    31.6400  -16.5200
            3   N1y N    33.0400  -16.5200
            4   C1y C    33.0400  -15.1200
            5   C1y C    34.3700  -16.9400
            6   C1z C    35.2100  -15.8200
            7   S2x S    34.3700  -14.7000
            8   C1a C    36.1900  -16.8000
            9   C1a C    36.1900  -14.8400
            10  C6a C    34.8600  -18.3400
            11  O6a O    36.2600  -18.3400 #-
            12  O6a O    34.0200  -19.4600
            13  N1b N    30.4500  -14.4200
            14  C5a C    29.2600  -15.1200
            15  O5x O    30.4500  -17.2200
            16  O5a O    29.2600  -16.5200
            17  C1c C    28.0000  -14.4200
            18  C8y C    28.0000  -13.0200
            19  C8x C    29.2600  -12.3200
            20  C8x C    29.2600  -10.9200
            21  C8x C    28.0000  -10.2200
            22  C8x C    26.8100  -10.9200
            23  C8x C    26.8100  -12.3200
            24  N1b N    26.8100  -15.1200
            25  C5a C    25.6200  -14.4200
            26  C8y C    24.3600  -15.1200
            27  O5a O    25.6200  -13.0200
            28  C8y C    23.1700  -14.4200
            29  C8y C    21.9100  -15.1200
            30  C8y C    21.9100  -16.5200
            31  N5x N    23.1700  -17.2200
            32  C8x C    24.3600  -16.5200
            33  N5x N    20.6976  -14.4200
            34  C8x C    19.4851  -15.1200
            35  C8x C    19.4851  -16.5200
            36  C8x C    20.6976  -17.2200
            37  O1a O    23.1872  -13.0201
            38  Z   Na   38.0800  -18.4100 #+
BOND        41
            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 2
            21   19  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 2
            25   18  23 1
            26   24  25 1
            27   25  26 1
            28   17  24 1 #Up
            29   25  27 2
            30   26  28 2
            31   28  29 1
            32   29  30 2
            33   30  31 1
            34   31  32 2
            35   26  32 1
            36   29  33 1
            37   33  34 2
            38   34  35 1
            39   35  36 2
            40   30  36 1
            41   28  37 1

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