<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">279077</id>
  <title nil="true"/>
  <common-name>N'-[[(2s)-2-bicyclo[2.2.1]heptanyl]methyl]-2-hydroxysulfonothioyloxyethanimidamide</common-name>
  <description>N'-[[(2s)-2-bicyclo[2.2.1]heptanyl]methyl]-2-hydroxysulfonothioyloxyethanimidamide belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. It has the formula C10H18N2O3S2 and an average molecular weight of 278.40 g/mol.</description>
  <cas>40283-67-8</cas>
  <pubchem-id>218159</pubchem-id>
  <chemical-formula>C10H18N2O3S2</chemical-formula>
  <weight>278.4</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">2026-08-26T18:59:04Z</created-at>
  <updated-at type="dateTime">2026-08-26T18:59:04Z</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>C1CC2CC1CC2CN=C(COS(=O)(=S)O)N</moldb-smiles>
  <moldb-formula>C10H18N2O3S2</moldb-formula>
  <moldb-inchi>InChI=1S/C10H18N2O3S2/c11-10(6-15-17(13,14)16)12-5-9-4-7-1-2-8(9)3-7/h7-9H,1-6H2,(H2,11,12)(H,13,14,16)/t7?,8?,9-/m1/s1</moldb-inchi>
  <moldb-inchikey>PQGFVOURRHRXKN-AMDVSUOASA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">278.0758848</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.2</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>CHEM274970</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]methyl]-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>CED0231145</sync-id>
  <structure-inchikey>PQGFVOURRHRXKN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>801040001000200800000000000000000000200000000000000000000000000000020000040000000000000000000000000000000000004000000000000000408000000000000020100001000100000004000000000000000000010000000000000000000000000000020000000000000000000000100000000000000000000000000000000000001000000000000000000000100000000800000004220400000000000000000204000002000000080000000000000000000000802000000000000000000000000000000000040000008000000000002000000000000000000000000000000000000000000000000000080000000001</structure-fingerprint>
  <structure-pattern-fingerprint>540208400142022080000000010820200100040001052000003420c08200000c4402009002b00800040041080080006807200024008c30010000647000a04000c411040002100400009010000062000000400580500148b240800c22402001200c2800070048820064000000d4340020202680100911e004113800200211c002004000084cc0000808000200382c0008311c0c5244001482030008802040008550c300000000c00002000940016c211002c00000884108401800421008400210800000a404800012018000000c01028004000020020040200d0002040800010000100810808800840000000101122000001000108042000e0000000050020042</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������`�������(�������(�������`������� ������ ������(�������(�������`�������h��������������������������������	(�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:54:30Z</structure-indexed-at>
</compound>
