360713 <common-name>(5-methylsulfanylpentanethioylamino) hydrogen sulfate</common-name> <description>(5-methylsulfanylpentanethioylamino) hydrogen sulfate is a chemical compound with the formula C6H13NO4S3. It has an average molecular weight of 259.40 g/mol.</description> <cas nil="true"/> <pubchem-id>123131540</pubchem-id> <chemical-formula>C6H13NO4S3</chemical-formula> <weight>259.4</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">2026-09-01T09:17:00Z</created-at> <updated-at type="dateTime">2026-09-01T09:17:00Z</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>CSCCCCC(=S)NOS(=O)(=O)O</moldb-smiles> <moldb-formula>C6H13NO4S3</moldb-formula> <moldb-inchi>InChI=1S/C6H13NO4S3/c1-13-5-3-2-4-6(12)7-11-14(8,9)10/h2-5H2,1H3,(H,7,12)(H,8,9,10)</moldb-inchi> <moldb-inchikey>ASMOKNJFABYERB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">259.0006714</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.6</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>CHEM356606</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>(5-methylsulfanylpentanethioylamino) hydrogen sulfate</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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0310874</sync-id> <structure-inchikey>ASMOKNJFABYERB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000000800040020800000000000000000000002000000000000000000000000000000000020004000000200000000000200000000000000000000000000000000000008000000000000020000000020100000000000000000000000000010000000000000000000000000000000000000000000000000000000000400040000000001000000000000080001002000000000400000000001000000000000000000000000000000080000000000000000000080000000000000000000008000000008000000000000000000000000020000000000000000000000000000000000000000000000000010000000200000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€���`������� ������`�������`�������`�������`�������(�������(�������h�������� ������ ������(�������(�������`��������������������������(��� � � � ��� ��� �B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:58:08Z</structure-indexed-at> </compound>