308146 <common-name>3-(2,5-dimethylphenyl)-4,8-dihydroxy-1-azaspiro[4.5]dec-3-en-2-one</common-name> <description>3-(2,5-dimethylphenyl)-4,8-dihydroxy-1-azaspiro[4.5]dec-3-en-2-one belongs to the xylenes, a subclass of benzene and substituted derivatives within the organic compounds. It is a benzenoid with the chemical formula C17H21NO3 and an average molecular weight of 287.35 g/mol.</description> <cas>1196708-00-5</cas> <pubchem-id>71262200</pubchem-id> <chemical-formula>C17H21NO3</chemical-formula> <weight>287.35</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">2026-08-29T02:29:43Z</created-at> <updated-at type="dateTime">2026-08-29T02:29:43Z</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>CC1=CC(=C(C=C1)C)C2=C(C3(CCC(CC3)O)NC2=O)O</moldb-smiles> <moldb-formula>C17H21NO3</moldb-formula> <moldb-inchi>InChI=1S/C17H21NO3/c1-10-3-4-11(2)13(9-10)14-15(20)17(18-16(14)21)7-5-12(19)6-8-17/h3-4,9,12,19-20H,5-8H2,1-2H3,(H,18,21)</moldb-inchi> <moldb-inchikey>WTHFWKYIZJQFDV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">287.1521435</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.8</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>CHEM304039</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>3-(2,5-dimethylphenyl)-4,8-dihydroxy-1-azaspiro[4.5]dec-3-en-2-one</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Xylenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0259175</sync-id> <structure-inchikey>WTHFWKYIZJQFDV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000000000000000000000000000000000000000000001000000000000000000020000000008000001000000000000000040000000000000000000000000000000000020000000000000020000000000000000000000000000001000000030000040000000000100800000010020000000000000000000004100000000048000000000000204000000000200000000000000000000000400000000000000004000000000000080100000000000000000000000000000000402000000100000000203000000000000040000000100000002000000200000000000000000100000000000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAVAAAAFwAAAIABBgBgAAAAAQMGQCgAAAAD BAZAaAAAAAMDAQZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEG AGAAAAABAwYAKAAAAAMEBgAoAAAAAwQGACAAAAAEBgBgAAAAAgIGAGAAAAAC AgYAYAAAAAMBBgBgAAAAAgIGAGAAAAACAggAYAAAAAEBBwBoAAAAAwIBBgAo AAAAAwQIACgAAAADAggAaAAAAAMBAQsAAQABAmgMAgNoDAMEaAwEBWgMBQZo DAQHAAMIIAgJKAIJCgAKCwALDAAMDQANDgAODwANEAAKEQAREiASEygCCRQg BgFoDBIIIA8KAEIDAAAABgEGBQQDAgUJCBIRCgYLDA0ODwoXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:16:07Z</structure-indexed-at> </compound>