126507 <common-name>Licofelone_M1</common-name> <description>Licofelone_M1 belongs to the substituted pyrroles, a subclass of pyrroles within the organic compounds. It is classified as an organoheterocyclic compound with the formula C29H32ClNO7. With an average molecular weight of 542.00 g/mol, Licofelone_M1 is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>154700127</pubchem-id> <chemical-formula>C29H32ClNO7</chemical-formula> <weight>542</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">2026-04-06T10:06:46Z</created-at> <updated-at type="dateTime">2026-08-31T14:10:19Z</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(CC2=C(C(=C(N2C1)CC(=O)OC[C@H]3[C@H]([C@H]([C@@H]([C@@H](O3)O)O)O)O)C4=CC=C(C=C4)Cl)C5=CC=CC=C5)C</moldb-smiles> <moldb-formula>C29H32ClNO7</moldb-formula> <moldb-inchi>InChI=1S/C29H32ClNO7/c1-29(2)13-20-24(16-6-4-3-5-7-16)23(17-8-10-18(30)11-9-17)19(31(20)15-29)12-22(32)37-14-21-25(33)26(34)27(35)28(36)38-21/h3-11,21,25-28,33-36H,12-15H2,1-2H3/t21-,25+,26+,27-,28+/m0/s1</moldb-inchi> <moldb-inchikey>YXNIWVFDFGNCED-NNVCNDCRSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">541.1867301</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM122400</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00117836</susdat-id> <iupac>[(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 2-[2-(4-chlorophenyl)-6,6-dimethyl-1-phenyl-5,7-dihydropyrrolizin-3-yl]acetate</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">71</paper-count> <sync-id>CED0021173</sync-id> <structure-inchikey>YXNIWVFDFGNCED-NNVCNDCRSA-N</structure-inchikey> <structure-fingerprint>200000c40000000000000010820000000001000080000000000000000000000002040000000000000004000000000080000000000000000000000000000000400080000020200080000020800000000100000000018000000000000000010082000000000000000000800000020118000000000400000000100004000048020000800000004000800000800400000100000000000000400020000000000000000000000000082000000002000000000000000100800000000000000000000000000000000000000000000010000000000000001200080000000000000000000800000042000000000440000000000000080000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������&���*���€���`������� ������`������@(������@(������@(������@(������@(�������`�������`�������(�������(�������(�������`������ 4������� 4������� 4������� 4������� 4�������� ������`�������`�������`�������`������@(������@h�������@h�������@(������@h�������@h�������� �����@(������@h�������@h�������@h�������@h�������@h��������`�����������������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">2026-09-19T04:47:56Z</structure-indexed-at> </compound>