<?xml version="1.0" encoding="UTF-8"?>
<compound>
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  <title nil="true"/>
  <common-name>Ceftezole</common-name>
  <description nil="true"/>
  <cas>26973-24-0</cas>
  <pubchem-id>65755</pubchem-id>
  <chemical-formula>C13H12N8O4S3</chemical-formula>
  <weight>440.5</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-03-31T20:30:47Z</created-at>
  <updated-at type="dateTime">2026-08-18T23:08:30Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id>DB13821</drugbank-id>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>OC(=O)C1=C(CSC2=NN=CS2)CS[C@@H]2[C@H](NC(=O)CN3C=NN=N3)C(=O)N12</moldb-smiles>
  <moldb-formula>C13H12N8O4S3</moldb-formula>
  <moldb-inchi>InChI=1S/C13H12N8O4S3/c22-7(1-20-4-14-18-19-20)16-8-10(23)21-9(12(24)25)6(2-26-11(8)21)3-27-13-17-15-5-28-13/h4-5,8,11H,1-3H2,(H,16,22)(H,24,25)/t8-,11-/m1/s1</moldb-inchi>
  <moldb-inchikey>DZMVCVMFETWNIU-LDYMZIIASA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">440.47</moldb-average-mass>
  <moldb-mono-mass type="decimal">440.014363</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-1.6</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>59178</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM057770</chemdb-id>
  <dsstox-id>DTXSID0022771</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00011571</susdat-id>
  <iupac>(6R,7R)-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organoheterocyclic compounds</superklass>
  <klass>Lactams</klass>
  <subklass>Beta lactams</subklass>
  <paper-count type="integer">137</paper-count>
  <sync-id>CED0017248</sync-id>
  <structure-inchikey>DZMVCVMFETWNIU-LDYMZIIASA-N</structure-inchikey>
  <structure-fingerprint>400000000c000000000804000000a0000000000000000200020000000c000000000004002000020004004000000102014000000000000000080020000000000000000000000000000000000000000000020000010000020000000000010402000000000010000000000001000802008000000020984000000000000030000100000000001002004000000000000000080080000040080000000000000000001000000008000000000000000080000000100000040000000000000000800000000000001000000000000000000000000000000000000800000000000000001000000100000000000000040000000000420000000000000000000000000000000</structure-fingerprint>
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  <structure-pickle>ï¾­Þ������������������������€���h��������(�������(�������(�������(�������`������� �����@(������@(������@(������@h�������@(�������`������� ����� 4������� 4��������h��������(�������(�������`������@(������@h�������@(������@(������@(�������(�������(�������(�������� ��(��� ��(������������h��	h�	
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	���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:15:07Z</structure-indexed-at>
</compound>
