278526 <common-name>2-hept-6-ynylpropanedioic acid</common-name> <description>2-hept-6-ynylpropanedioic acid belongs to the fatty acids and conjugates, a subclass of fatty acyls within the organic compounds. This compound has the formula C10H14O4 and an average molecular weight of 198.22 g/mol. It is further classified under the superclass of lipids and lipid-like molecules.</description> <cas>90927-19-8</cas> <pubchem-id>167717834</pubchem-id> <chemical-formula>C10H14O4</chemical-formula> <weight>198.22</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">2026-08-26T18:26:44Z</created-at> <updated-at type="dateTime">2026-08-26T18:26:44Z</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#CCCCCCC(C(=O)O)C(=O)O</moldb-smiles> <moldb-formula>C10H14O4</moldb-formula> <moldb-inchi>InChI=1S/C10H14O4/c1-2-3-4-5-6-7-8(9(11)12)10(13)14/h1,8H,3-7H2,(H,11,12)(H,13,14)</moldb-inchi> <moldb-inchikey>QNTYJXVBBNVWQY-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">198.0892089</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.1</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>CHEM274419</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-hept-6-ynylpropanedioic 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>Lipids and lipid-like molecules</superklass> <klass>Fatty Acyls</klass> <subklass>Fatty acids and conjugates</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0230618</sync-id> <structure-inchikey>QNTYJXVBBNVWQY-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000900000000000000000000000000000000000000000000000000000000000000000000000000004000004000000008000000000000000000000000200000000000000000000000020000020000000000000001000000000000000010000000000000000000000000010000000000000020000000000000000000000000000000000000000010000000000000000000000000000000000100000000000000000000000000000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000000000000800000000000000010401000000001000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€���h��������(�������`�������`�������`�������`�������`�������`�������(�������(�������h��������(�������(�������h��������������������������������� (�� �����(�� B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:54:01Z</structure-indexed-at> </compound>