342577 <common-name>3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-2,6,6-trimethyl-1-phenyl-5,7-dihydroindol-4-one</common-name> <description>3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-2,6,6-trimethyl-1-phenyl-5,7-dihydroindol-4-one is a chemical compound with the formula C25H29NO3. It has an average molecular weight of 391.50 g/mol.</description> <cas>118472-63-2</cas> <pubchem-id>3088568</pubchem-id> <chemical-formula>C25H29NO3</chemical-formula> <weight>391.5</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">2026-08-31T03:33:49Z</created-at> <updated-at type="dateTime">2026-08-31T03:33:49Z</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=C(N1C3=CC=CC=C3)CC(CC2=O)(C)C)C4=C(CC(CC4=O)(C)C)O</moldb-smiles> <moldb-formula>C25H29NO3</moldb-formula> <moldb-inchi>InChI=1S/C25H29NO3/c1-15-21(23-19(28)13-25(4,5)14-20(23)29)22-17(11-24(2,3)12-18(22)27)26(15)16-9-7-6-8-10-16/h6-10,28H,11-14H2,1-5H3</moldb-inchi> <moldb-inchikey>YNMGHQWHBRPGRE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">391.2147438</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.5</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>CHEM338470</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-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-2,6,6-trimethyl-1-phenyl-5,7-dihydroindol-4-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>Organoheterocyclic compounds</superklass> <klass>Pyrroles</klass> <subklass>Substituted pyrroles</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0292966</sync-id> <structure-inchikey>YNMGHQWHBRPGRE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>208000000000000000000004000000002000000000000000000000000010000020000080000000000004000000000000000000000000000000000000000000000000000000000000000020000000000080000000010001000000000000010000800000000000000000000000020108000000000000000000000000004048000000800800000000000000000000000300000000000000000020000004000000000000000000080000000002000000000000000100000000000000000000000000202000000000100000000000000000002000001200020000000000000040000000000040000000000000004000000000000040040000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€���`������@(������@(������@(������@(������@(������@(������@h�������@h�������@h�������@h�������@h��������`������� ������`�������(�������(�������`�������`�������(�������(�������`������� ������`�������(�������(�������`�������`�������h������������h���h���h���h��� ��h���h�� h� h� �h����� � �������(� �� ���� ��(���������������(��������� ��h��� ��h��� B������������� ���� ���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:42:10Z</structure-indexed-at> </compound>