<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">289513</id>
  <title nil="true"/>
  <common-name>2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxa-4-azaspiro[2.5]octan-6-yl]acetic acid</common-name>
  <description>2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxa-4-azaspiro[2.5]octan-6-yl]acetic acid belongs to the morpholines, a subclass of oxazinanes within the organic compounds. This organoheterocyclic compound has the chemical formula C13H21NO5 and an average molecular weight of 271.31 g/mol.</description>
  <cas>2408966-42-5</cas>
  <pubchem-id>165671484</pubchem-id>
  <chemical-formula>C13H21NO5</chemical-formula>
  <weight>271.31</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">2026-08-28T03:01:03Z</created-at>
  <updated-at type="dateTime">2026-08-28T03:01:03Z</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>CC(C)(C)OC(=O)N1CC(OCC12CC2)CC(=O)O</moldb-smiles>
  <moldb-formula>C13H21NO5</moldb-formula>
  <moldb-inchi>InChI=1S/C13H21NO5/c1-12(2,3)19-11(17)14-7-9(6-10(15)16)18-8-13(14)4-5-13/h9H,4-8H2,1-3H3,(H,15,16)</moldb-inchi>
  <moldb-inchikey>DEYJMXSCWQSUPH-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">271.1419728</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.7</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>CHEM285406</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-[4-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxa-4-azaspiro[2.5]octan-6-yl]acetic 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>Oxazinanes</klass>
  <subklass>Morpholines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0241199</sync-id>
  <structure-inchikey>DEYJMXSCWQSUPH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000002000000000000010000000000000050000000000000000000080000000000000000004800008000000000000000000000000000000000000000000000000000000000020800000000100000010001000000000000000210000000000000000100000000000020100000000000000000800100000000048400000000000000000000000200000000000000080000000000010000000000010000000000000000100000000400000000000000000000000000000040000020000000000000000000000000000000000000000402000000000000000000000000000100000000000000400000000000000000000000000800000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������(�������(�������(�������(�������`�������`������� ������`������� ������`�������`�������`�������(�������(�������h��������������������� ��(��� ����	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:02:23Z</structure-indexed-at>
</compound>
