<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">365464</id>
  <title nil="true"/>
  <common-name>N'-[(2s)-2-bicyclo[2.2.1]heptanyl]-2-hydroxysulfonothioyloxyethanimidamide</common-name>
  <description>N'-[(2s)-2-bicyclo[2.2.1]heptanyl]-2-hydroxysulfonothioyloxyethanimidamide is a chemical compound with the formula C9H16N2O3S2. It has an average molecular weight of 264.40 g/mol.</description>
  <cas>40283-65-6</cas>
  <pubchem-id>218158</pubchem-id>
  <chemical-formula>C9H16N2O3S2</chemical-formula>
  <weight>264.4</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">2026-09-01T16:03:55Z</created-at>
  <updated-at type="dateTime">2026-09-01T16:03:55Z</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>C1CC2CC1CC2N=C(COS(=O)(=S)O)N</moldb-smiles>
  <moldb-formula>C9H16N2O3S2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H16N2O3S2/c10-9(5-14-16(12,13)15)11-8-4-6-1-2-7(8)3-6/h6-8H,1-5H2,(H2,10,11)(H,12,13,15)/t6?,7?,8-/m0/s1</moldb-inchi>
  <moldb-inchikey>VWZJKIUSSAXDAH-RRQHEKLDSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">264.0602347</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.7</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>CHEM361357</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>N'-[(2s)-2-bicyclo[2.2.1]heptanyl]-2-hydroxysulfonothioyloxyethanimidamide</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>Lipids and lipid-like molecules</superklass>
  <klass>Prenol lipids</klass>
  <subklass>Monoterpenoids</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0315417</sync-id>
  <structure-inchikey>VWZJKIUSSAXDAH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>801040000000200800000002000000000000000000000000000000000000000000020000040000000000000000000000000400000000004000000000020000408000200000000020000001000100000004000000000000000000010000000000000000000000000000020000000000000010000000100000000000000000000000000000000000001000000000000000000000000000000800000004820400000000000000000000000002000000080000000000000000000200802000000000000000000000000000000000040000000000000000000000000000000000000000000000000000000000000000000000080000000001</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������(�������(�������`������� ������ ������(�������(�������`�������h������������������������������(��	�	
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  <structure-indexed-at type="dateTime">2026-09-19T06:01:32Z</structure-indexed-at>
</compound>
