105517 <common-name>Buthionine Sulfoxime</common-name> <description>Buthionine Sulfoxime belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C8H18N2O3S and an average molecular weight of 222.30 g/mol.</description> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C8H18N2O3S</chemical-formula> <weight nil="true"/> <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">2026-04-05T12:28:39Z</created-at> <updated-at type="dateTime">2026-04-05T12:28:39Z</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>CCCCS(=N)(=O)CCC(N)C(O)=O</moldb-smiles> <moldb-formula>C8H18N2O3S</moldb-formula> <moldb-inchi>InChI=1S/C8H18N2O3S/c1-2-3-5-14(10,13)6-4-7(9)8(11)12/h7,10H,2-6,9H2,1H3,(H,11,12)/t7-,14+/m0/s1</moldb-inchi> <moldb-inchikey>KJQFBVYMGADDTQ-JKYUHCHBSA-N</moldb-inchikey> <moldb-average-mass type="decimal">222.3</moldb-average-mass> <moldb-mono-mass type="decimal">222.1038134</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM101410</chemdb-id> <dsstox-id>DTXSID6044434</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00070553</susdat-id> <iupac nil="true"/> <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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer">45</paper-count> <sync-id>CED0024042</sync-id> <structure-inchikey>KJQFBVYMGADDTQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000004800000000000000000000000400000000000800000000000000002000000000000020000000004000008000000000000000040000000000000000000000000010000000100000020000000000000000000001040000000002020010000000000000000000000000000000000000000000000000000000000000040002000000000000000000000001000000000000000000000000000000000000000000000000000000000000000100000000000080000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000840000000000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€���`�������`�������`�������`������� ������h��������(�������`�������`�������`�������`�������(�������h��������(��������������������������������� � � ���� � (�B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:41:52Z</structure-indexed-at> </compound>