<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">305233</id>
  <title nil="true"/>
  <common-name>Ethyl 7'-amino-5-fluoro-2,2',4'-trioxospiro[1h-indole-3,5'-1h-pyrano[2,3-d]pyrimidine]-6'-carboxylate</common-name>
  <description>Ethyl 7'-amino-5-fluoro-2,2',4'-trioxospiro[1h-indole-3,5'-1h-pyrano[2,3-d]pyrimidine]-6'-carboxylate belongs to the pyranopyrimidines, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C17H13FN4O6 and an average molecular weight of 388.31 g/mol.</description>
  <cas>116743-81-8</cas>
  <pubchem-id>3087895</pubchem-id>
  <chemical-formula>C17H13FN4O6</chemical-formula>
  <weight>388.31</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">2026-08-28T22:47:06Z</created-at>
  <updated-at type="dateTime">2026-08-28T22:47:06Z</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>CCOC(=O)C1=C(OC2=C(C13C4=C(C=CC(=C4)F)NC3=O)C(=O)NC(=O)N2)N</moldb-smiles>
  <moldb-formula>C17H13FN4O6</moldb-formula>
  <moldb-inchi>InChI=1S/C17H13FN4O6/c1-2-27-14(24)9-11(19)28-13-10(12(23)21-16(26)22-13)17(9)7-5-6(18)3-4-8(7)20-15(17)25/h3-5H,2,19H2,1H3,(H,20,25)(H2,21,22,23,26)</moldb-inchi>
  <moldb-inchikey>DLYZEKORVBAEPB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">388.0819123</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>-0.1</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>CHEM301126</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>Ethyl 7'-amino-5-fluoro-2,2',4'-trioxospiro[1h-indole-3,5'-1h-pyrano[2,3-d]pyrimidine]-6'-carboxylate</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>Pyranopyrimidines</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0256337</sync-id>
  <structure-inchikey>DLYZEKORVBAEPB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>41000000000000208000000000000000500000000004000400400000000800000000020000200000000000000000000000080000000000000000000000000000000000000000000000000000000000208000000001100040000040020100800002000100000000000200001002000004000000000000000000000000000000010000480000000000002000000000000010000000000000100200000000000000200000000000000000000800001021000000000040000001040000000000000000000000000000000020000000000200000000000020000042000000000000002000000000000000400000000004008000000000000a0000080000008000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������(�������(�������(������@(������@(������� �����@(������@(������@h�������@h�������@(������@h������	� ������h��������(�������(������@(�������(������@8�������@(�������(������@8��������h��������������� ��(��� ��(��� �� �	h�	
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�������	����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:14:02Z</structure-indexed-at>
</compound>
