<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">299960</id>
  <title nil="true"/>
  <common-name>Dimethyl 2-amino-3-oxophenoxazine-4,6-dicarboxylate</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>72723</pubchem-id>
  <chemical-formula>C16H12N2O6</chemical-formula>
  <weight>328.28</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">2026-08-28T16:40:53Z</created-at>
  <updated-at type="dateTime">2026-08-28T16:40:53Z</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>COC(=O)C1=C2C(=CC=C1)N=C3C=C(C(=O)C(=C3O2)C(=O)OC)N</moldb-smiles>
  <moldb-formula>C16H12N2O6</moldb-formula>
  <moldb-inchi>InChI=1S/C16H12N2O6/c1-22-15(20)7-4-3-5-9-13(7)24-14-10(18-9)6-8(17)12(19)11(14)16(21)23-2/h3-6H,17H2,1-2H3</moldb-inchi>
  <moldb-inchikey>VDXGQNZVNDDQND-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">328.0695361</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.9</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>CHEM295853</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>Dimethyl 2-amino-3-oxophenoxazine-4,6-dicarboxylate</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>Benzoxazines</klass>
  <subklass>Phenoxazines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0251242</sync-id>
  <structure-inchikey>VDXGQNZVNDDQND-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>400400000000000000000000000000000000000400000200000000000000020000000000000000000000000000000000004000000000000002000000000008000208000000001000000000010000000000000000100000000400000001000000022000000800000000008000000000008010000400000008040000000a0020081001000000000000000000000000000000000000000000000000000080000001000000001004000000000000000000000000000040000000800000000000000002000000000000000000200000000000000000000000001000040000000000400000000008000000100000000080000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(�������(�������(������@(������@(������@(������@h�������@h�������@h�������@(������@(������@h�������@(������@(�������(������@(������@(������@(�������(�������(�������(�������`�������h������������ ��(��� ��h���h���h���h��	h��
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���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:10:09Z</structure-indexed-at>
</compound>
