141270 <common-name>Aranotin</common-name> <description>Aranotin belongs to the piperazines, a subclass of diazinanes within the organic compounds. It is classified as an organoheterocyclic compound with the formula C20H18N2O7S2. The compound has an average molecular weight of 462.49 g/mol.</description> <cas>19885-51-9</cas> <pubchem-id>10412012</pubchem-id> <chemical-formula>C20H18N2O7S2</chemical-formula> <weight>462.5</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">2026-04-15T17:35:36Z</created-at> <updated-at type="dateTime">2026-08-20T05:06:47Z</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>DB20753</drugbank-id> <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>[H][C@@]12[C@@H](O)C=COC=C1C[C@@]13SS[C@]4(CC5=COC=C[C@H](OC(C)=O)[C@@]5([H])N4C1=O)C(=O)N23</moldb-smiles> <moldb-formula>C20H18N2O7S2</moldb-formula> <moldb-inchi>InChI=1S/C20H18N2O7S2/c1-10(23)29-14-3-5-28-9-12-7-20-17(25)21-15-11(8-27-4-2-13(15)24)6-19(21,30-31-20)18(26)22(20)16(12)14/h2-5,8-9,13-16,24H,6-7H2,1H3/t13-,14-,15+,16+,19-,20-/m0/s1</moldb-inchi> <moldb-inchikey>HXWOWBFXYUFFKS-PSJNWGMYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">462.49</moldb-average-mass> <moldb-mono-mass type="decimal">462.055543276</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-1.4</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> 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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>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer">50</paper-count> <sync-id>CED0023460</sync-id> <structure-inchikey>HXWOWBFXYUFFKS-PSJNWGMYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000000000020000000000008000000001000000000200002000000000000000000000000000000000000000000000000000402000100000020000000000000000002080001000018000000000000000000000000001004000000000000000000010000002010c000000000000000000500010000048202018000000000200000000000000001000000000020000400000000200000000000000000000080000000000000000000000000000000040000000000400000000020800000000000000000000000000000000000000000008000800000000000000000040000000000400000000000200080000000000000000</structure-fingerprint> 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