Marvin  02031016112D          

 33 36  0  0  0  0            999 V2000
    6.2416   -4.1875    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.5683   -4.6742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8250   -5.4625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6541   -5.4625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9109   -4.6742    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1833   -3.4416    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.1833   -4.2666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3650   -0.9374    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6207   -1.7280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5375   -0.9346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9542   -3.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6708   -3.4416    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2417   -3.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.2458   -4.2708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4708   -3.0291    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4667   -4.6750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0083   -3.4416    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.0083   -4.2666    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7189   -4.6769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4339   -4.2666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4339   -3.4416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7189   -3.0269    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0042   -2.6166    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7125   -5.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9958   -5.9083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4250   -5.9125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1458   -4.6791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8583   -4.2625    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
 14 16  1  0  0  0  0
  9 10  2  0  0  0  0
 15 17  1  0  0  0  0
  1  2  1  0  0  0  0
 17 18  1  0  0  0  0
  3  4  1  0  0  0  0
 16 19  2  0  0  0  0
  4  5  2  0  0  0  0
 16 20  1  0  0  0  0
  6 20  1  1  0  0  0
  5  1  1  0  0  0  0
  7 21  2  0  0  0  0
 22 23  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  8  1  0  0  0  0
  2  3  2  0  0  0  0
 22 27  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 12 13  1  0  0  0  0
 22 28  1  6  0  0  0
 24 29  1  0  0  0  0
 10 14  1  0  0  0  0
 29 30  2  0  0  0  0
  7 23  1  0  0  0  0
 29 31  1  0  0  0  0
 14 15  2  0  0  0  0
 25 32  1  0  0  0  0
 22  6  1  0  0  0  0
 32 33  1  0  0  0  0
 33  2  1  0  0  0  0
M  END
> <ID>
CHEBI:55488

> <NAME>
cefuzonam

> <DEFINITION>
A second generation cephalosporin antibiotic.

> <STAR>
3

> <SYNONYM>
cefuzoname

> <IUPAC_NAME>
7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-[(1,2,3-thiadiazol-5-ylsulfanyl)methyl]-3,4-didehydrocepham-4-carboxylic acid; (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-8-oxo-3-[(1,2,3-thiadiazol-5-ylsulfanyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

> <INN>
cefuzonamum; cefuzonam

> <FORMULA>
C16H15N7O5S4

> <MASS>
513.59400

> <MONOISOTOPIC_MASS>
513.00175

> <CHARGE>
0

> <SMILES>
[H][C@]12SCC(CSc3cnns3)=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\c1csc(N)n1)C(O)=O

> <INCHI>
InChI=1S/C16H15N7O5S4/c1-28-21-9(7-5-31-16(17)19-7)12(24)20-10-13(25)23-11(15(26)27)6(4-30-14(10)23)3-29-8-2-18-22-32-8/h2,5,10,14H,3-4H2,1H3,(H2,17,19)(H,20,24)(H,26,27)/b21-9-/t10-,14-/m1/s1

> <INCHIKEY>
CXHKZHZLDMQGFF-ZSDSSEDPSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
6030288

> <CAS_REGISTRY_NUMBER>
82219-78-1

> <REAXYS_REGISTRY_NUMBER>
6030288

> <CHEMIDPLUS>
82219-78-1

> <KEGG_DRUG_ACCESSION>
D03432

> <WIKIPEDIA_ACCESSION>
Cefuzonam

> <PUBMED_CITATION>
2041152; 2042464; 3329242; 3530123; 3599391; 7933531

$$$$