<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">362959</id>
  <title nil="true"/>
  <common-name>2,2,2-trifluoro-n-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide</common-name>
  <description>2,2,2-trifluoro-n-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide is a chemical compound with the formula C8H12F3NO6. It has an average molecular weight of 275.18 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>549476</pubchem-id>
  <chemical-formula>C8H12F3NO6</chemical-formula>
  <weight>275.18</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">2026-09-01T12:24:30Z</created-at>
  <updated-at type="dateTime">2026-09-01T12:24:30Z</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 nil="true"/>
  <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>C(C(C(C(C(C=O)NC(=O)C(F)(F)F)O)O)O)O</moldb-smiles>
  <moldb-formula>C8H12F3NO6</moldb-formula>
  <moldb-inchi>InChI=1S/C8H12F3NO6/c9-8(10,11)7(18)12-3(1-13)5(16)6(17)4(15)2-14/h1,3-6,14-17H,2H2,(H,12,18)</moldb-inchi>
  <moldb-inchikey>AIJZHZABXNACMO-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">275.0616716</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-2.3</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <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>CHEM358852</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>2,2,2-trifluoro-n-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide</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>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Carbohydrates and carbohydrate conjugates</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0313003</sync-id>
  <structure-inchikey>AIJZHZABXNACMO-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000800000002400000000000040000000000002100000002000000000000000000000000000200000000000000000000000000020200018000000000000000000000000000000000020400000000200000000000000000020000000010000050000000000000080000000000000000000000000400800000000000000000000000000000000000080000000000000000000000000000000000000000000000080000000000000400000000000040000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000400800000000000000000000000400000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������h��������(�������h��������(�������(������� ����	� ����	� ����	� ������`�������`�������`�������`������������������������������ �	(��
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  <structure-indexed-at type="dateTime">2026-09-19T05:59:49Z</structure-indexed-at>
</compound>
