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<compound>
  <id type="integer">43447</id>
  <title nil="true"/>
  <common-name>O-succinyl-L-homoserine</common-name>
  <description>O-succinyl-L-homoserine belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This organic acid and derivative has the formula C8H13NO6 and an average molecular weight of 219.19 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>439406</pubchem-id>
  <chemical-formula>C8H13NO6</chemical-formula>
  <weight nil="true"/>
  <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">2016-05-27T01:59:17Z</created-at>
  <updated-at type="dateTime">2026-04-05T14:33:01Z</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>N[C@@H](CCOC(=O)CCC(O)=O)C(O)=O</moldb-smiles>
  <moldb-formula>C8H13NO6</moldb-formula>
  <moldb-inchi>InChI=1S/C8H13NO6/c9-5(8(13)14)3-4-15-7(12)2-1-6(10)11/h5H,1-4,9H2,(H,10,11)(H,13,14)/t5-/m0/s1</moldb-inchi>
  <moldb-inchikey>GNISQJGXJIDKDJ-YFKPBYRVSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">219.1919</moldb-average-mass>
  <moldb-mono-mass type="decimal">219.074287153</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <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>CHEM042342</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00074256</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>126.92000000000002</moldb-polar-surface-area>
  <moldb-refractivity>46.95120000000001</moldb-refractivity>
  <moldb-polarizability>20.513811131589183</moldb-polarizability>
  <moldb-rotatable-bond-count>8</moldb-rotatable-bond-count>
  <moldb-acceptor-count>6</moldb-acceptor-count>
  <moldb-donor-count>3</moldb-donor-count>
  <moldb-pka-strongest-acidic>1.688067433289202</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>9.458196258009957</moldb-pka-strongest-basic>
  <moldb-physiological-charge>-1</moldb-physiological-charge>
  <moldb-number-of-rings>0</moldb-number-of-rings>
  <moldb-alogps-logp>-3.31</moldb-alogps-logp>
  <moldb-alogps-logs>-1.40</moldb-alogps-logs>
  <moldb-alogps-solubility>8.69e+00 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer">376</paper-count>
  <sync-id>CED0012283</sync-id>
  <structure-inchikey>GNISQJGXJIDKDJ-YFKPBYRVSA-N</structure-inchikey>
  <structure-fingerprint>40040000000000000000800000000000000010000000000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000020000004800100000000001000000000002000010000000000000000000000000000000000000000000000000000000020000000000000000000000000000000001000000000000000000000800000010000000000000000000000002000000001100000000000000000000000000000000008000000000000000000000000000000000000000000400000000000010000000000000840000000000000000400000000004000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:11:25Z</structure-indexed-at>
</compound>
