285281 <common-name>2-[3-oxo-2-[(z)-4-sulfooxypent-2-enyl]cyclopentyl]acetic acid</common-name> <description>2-[3-oxo-2-[(z)-4-sulfooxypent-2-enyl]cyclopentyl]acetic acid is a compound with the formula C12H18O7S. It has an average molecular weight of 306.33 g/mol.</description> <cas nil="true"/> <pubchem-id>126843512</pubchem-id> <chemical-formula>C12H18O7S</chemical-formula> <weight>306.33</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">2026-08-27T21:01:05Z</created-at> <updated-at type="dateTime">2026-08-27T21:01:05Z</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=CCC1C(CCC1=O)CC(=O)O)OS(=O)(=O)O</moldb-smiles> <moldb-formula>C12H18O7S</moldb-formula> <moldb-inchi>InChI=1S/C12H18O7S/c1-8(19-20(16,17)18)3-2-4-10-9(7-12(14)15)5-6-11(10)13/h2-3,8-10H,4-7H2,1H3,(H,14,15)(H,16,17,18)/b3-2-</moldb-inchi> <moldb-inchikey>XOANNBHPTKIFSM-IHWYPQMZSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">306.0773241</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>CHEM281174</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-[3-oxo-2-[(z)-4-sulfooxypent-2-enyl]cyclopentyl]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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0237110</sync-id> <structure-inchikey>XOANNBHPTKIFSM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000200000000000800080000000000202000002000000000002200800000000001000000020000000020000200004000000000000100000000000000000000000000000000000008000000000000020000000000300000000000000000100000009010000000000000000000000000000020000000000000000000800100000400040000000000000000000000000000800000000000000000000000000800000000004000020080000080000000000000000000000080000000000000000000000000000000000008000000000000000000000000000602000000000000000000000000010000000000000000400000000000000000000020000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFAAAAIABBgBgAAAAAQMGAGAAAAAD AQYAaAAAAAMDAQYAaAAAAAMDAQYAYAAAAAICBgBgAAAAAwEGAGAAAAADAQYA YAAAAAICBgBgAAAAAgIGACgAAAADBAgAKAAAAAMCBgBgAAAAAgIGACgAAAAD BAgAKAAAAAMCCABoAAAAAwEBCAAgAAAAAhAAIAAAAAYIACgAAAADAggAKAAA AAMCCABgAAAAAQELAAEAAQIAAgMIAgMEAAQFAAUGAAYHAAcIAAgJAAkKCAIG CwALDAAMDSgCDA4gAQ8ADxAAEBEIAhASCAIQEwAJBQBCAQAAAAUFBgcICRcE AAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:59:18Z</structure-indexed-at> </compound>