321061 <common-name>2-[5-(4-methoxybenzoyl)-6-methyl-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid</common-name> <description>2-[5-(4-methoxybenzoyl)-6-methyl-[1,3]dioxolo[4,5-f]indol-7-yl]acetic acid is a chemical compound with the formula C20H17NO6. It has an average molecular weight of 367.40 g/mol.</description> <cas>50332-05-3</cas> <pubchem-id>39615</pubchem-id> <chemical-formula>C20H17NO6</chemical-formula> <weight>367.4</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">2026-08-29T20:17:24Z</created-at> <updated-at type="dateTime">2026-08-29T20:17:24Z</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=C(C2=CC3=C(C=C2N1C(=O)C4=CC=C(C=C4)OC)OCO3)CC(=O)O</moldb-smiles> <moldb-formula>C20H17NO6</moldb-formula> <moldb-inchi>InChI=1S/C20H17NO6/c1-11-14(8-19(22)23)15-7-17-18(27-10-26-17)9-16(15)21(11)20(24)12-3-5-13(25-2)6-4-12/h3-7,9H,8,10H2,1-2H3,(H,22,23)</moldb-inchi> <moldb-inchikey>ZEQBURZLVOHZFU-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">367.1055873</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.5</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>CHEM316954</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-[5-(4-methoxybenzoyl)-6-methyl-[1,3]dioxolo[4,5-f]indol-7-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>Indoles and derivatives</klass> <subklass>Benzoylindoles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0271787</sync-id> <structure-inchikey>ZEQBURZLVOHZFU-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000800000000000000040000000000000000000000000000000000000000000240000000100000004000000000000400000000000000000000000000000000000000000000000000020800000000100000a00002000000000040000010000010040002000100000000020020100000000000000000000000000000040000000000000000000080000000000000000000400000000000000200000000000000004040000084000000000000000000000000000008100000080000000000000000000000040000000000000004000002000400200020000000080000000000000010040000000400400000000000000000000000004002010</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAbAAAAHgAAAIABBgBgAAAAAQMGQCgAAAAD BAZAKAAAAAMEBkAoAAAAAwQGQGgAAAADAwEGQCgAAAADBAZAKAAAAAMEBkBo AAAAAwMBBkAoAAAAAwQHQCgAAAADAwYAKAAAAAMECAAoAAAAAwIGQCgAAAAD BAZAaAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB CAAoAAAAAwIGAGAAAAABAwgAKAAAAAMCBgBgAAAAAgIIACgAAAADAgYAYAAA AAICBgAoAAAAAwQIACgAAAADAggAaAAAAAMBAQsAAQABAmgMAgNoDAMEaAwE BWgMBQZoDAYHaAwHCGgMCAloDAkKIAoLKAIKDCAMDWgMDQ5oDA4PaAwPEGgM EBFoDA8SIBITAAYUIBQVABUWAAIXABcYABgZKAIYGiAJAWgMCANoDBYFIBEM aAxCBAAAAAUBAgMICQYEBQYHCAMGDQ4PEBEMBRQGBRYVFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:26:01Z</structure-indexed-at> </compound>