KEGG   COMPOUND: C14021
Entry
C14021                      Compound                               
Name
Ticarcillin disodium;
Aerugipen
Formula
C15H14N2O6S2. 2Na
Exact mass
428.0089
Mol weight
428.391
Structure
Remark
Same as: D02241
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01C BETA-LACTAM ANTIBACTERIALS, PENICILLINS
    J01CA Penicillins with extended spectrum
     J01CA13 Ticarcillin
      D02241  Ticarcillin disodium (USP)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01713  Penicillin skeleton group
    DG01480  Penicillin
     DG00527  Ticarcillin
      D02241  Ticarcillin disodium
  DG01780  Extended spectrum penicillin
   DG00527  Ticarcillin
    D02241  Ticarcillin disodium
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Extended spectrum penicillin
    D02241  Ticarcillin disodium (USP)
Other DBs
CAS: 4697-14-7
PubChem: 854262
ChEBI: 35017
NIKKAJI: J8.765C
KCF data

ATOM        27
            1   C1y C    32.6200  -17.5000
            2   C5x C    32.6200  -18.9000
            3   N1y N    34.0200  -18.9000
            4   C1y C    34.0200  -17.5000
            5   C1y C    35.3500  -19.3200
            6   C1z C    36.1900  -18.2000
            7   S2x S    35.3500  -17.0800
            8   C1a C    37.1700  -19.1800
            9   C1a C    37.1700  -17.2200
            10  C6a C    35.8400  -20.6500
            11  O6a O    37.2400  -20.6500 #-
            12  O6a O    35.0000  -21.7700
            13  N1b N    31.4300  -16.8000
            14  C5a C    30.3100  -17.5000
            15  O5x O    31.4300  -19.6000
            16  O5a O    30.3100  -18.9000
            17  C1c C    29.0500  -16.8000
            18  C6a C    27.7900  -17.5000
            19  C8y C    29.0500  -15.4000
            20  O6a O    26.6000  -16.8000 #-
            21  O6a O    27.7900  -18.9000
            22  C8x C    30.2400  -14.4900
            23  C8x C    29.7500  -13.1600
            24  S2x S    28.3500  -13.1600
            25  C8x C    27.9300  -14.5600
            26  Z   Na   24.6400  -16.8700 #+
            27  Z   Na   38.6400  -20.7900 #+
BOND        27
            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 #Down
            20   17  19 1
            21   18  20 1
            22   18  21 2
            23   19  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 1
            27   19  25 2

» Japanese version

DBGET integrated database retrieval system