KEGG   COMPOUND: C13016
Entry
C13016                      Compound                               
Name
Carumonam sodium
Formula
C12H12N6O10S2. 2Na
Exact mass
509.9852
Mol weight
510.3674
Structure
Remark
Same as: D01560
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01D OTHER BETA-LACTAM ANTIBACTERIALS
    J01DF Monobactams
     J01DF02 Carumonam
      D01560  Carumonam sodium (JP18/USAN)
Drug groups [BR:br08330]
 Antibacterial
  DG01710  beta-Lactam antibiotic
   DG01454  Monobactam
    DG00590  Carumonam
     D01560  Carumonam sodium
  DG01804  Oxyimino beta-lactam
   DG00590  Carumonam
    D01560  Carumonam sodium
Antimicrobials [BR:br08307]
 Antibacterials
  Cell wall biosynthesis inhibitor, beta-lactam
   Monobactam
    D01560  Carumonam sodium (JP18/USAN)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01560  Carumonam sodium
Other DBs
CAS: 86832-68-0
PubChem: 583405
ChEBI: 31363
NIKKAJI: J39.453J
KCF data

ATOM        32
            1   C1y C    25.5864  -21.2498
            2   C5x C    25.5878  -22.6461
            3   N1y N    26.9097  -22.6373
            4   C1y C    26.9712  -21.2449
            5   S4a S    27.9796  -23.6236
            6   O5x O    24.6054  -23.6412
            7   O1d O    28.9903  -24.6215 #-
            8   N1b N    24.8834  -20.0325
            9   O1d O    28.9688  -22.5870
            10  O1d O    27.0215  -24.6279
            11  C1b C    27.9533  -20.3021
            12  O7a O    29.3638  -20.3021
            13  C7a C    30.0656  -19.0864
            14  N1a N    31.4503  -19.0866
            15  O6a O    29.3576  -17.8595
            16  C5a C    23.6760  -20.7448
            17  C2c C    22.4579  -20.0416
            18  C8y C    21.2398  -20.7448
            19  C8x C    20.0218  -20.0416
            20  O5a O    23.6827  -22.1513
            21  N2b N    22.4579  -18.6353
            22  S2x S    18.9764  -20.9828
            23  C8y C    19.5486  -22.2677
            24  N5x N    20.9474  -22.1207
            25  N1a N    18.8348  -23.5036
            26  O2a O    23.6052  -17.9210
            27  C1b C    23.6052  -16.5145
            28  C6a C    22.4039  -15.8211
            29  O6a O    21.2020  -16.5152 #-
            30  O6a O    22.4038  -14.4158
            31  Z   Na   30.9362  -24.5647 #+
            32  Z   Na   19.3315  -16.5253 #+
BOND        31
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     1   4 1
            5     3   5 1
            6     2   6 2
            7     5   7 1
            8     1   8 1 #Up
            9     5   9 2
            10    5  10 2
            11    4  11 1 #Up
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   13  15 2
            16    8  16 1
            17   16  17 1
            18   17  18 1
            19   18  19 2
            20   16  20 2
            21   17  21 2
            22   19  22 1
            23   22  23 1
            24   23  24 2
            25   18  24 1
            26   23  25 1
            27   26  27 1
            28   27  28 1
            29   28  29 1
            30   28  30 2
            31   21  26 1

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