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<compound>
  <id type="integer">121705</id>
  <title nil="true"/>
  <common-name>(+/-)-3,4-Methylenedioxymethamphetamine-D5 (MDMA-d5)</common-name>
  <description>(+/-)-3,4-Methylenedioxymethamphetamine-D5 (MDMA-d5) belongs to the benzodioxoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C11H10D5NO2 and an average molecular weight of 198.28 g/mol.</description>
  <cas>136765-43-0</cas>
  <pubchem-id>56845872</pubchem-id>
  <chemical-formula>C11H10D5NO2</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">2026-04-06T04:40:06Z</created-at>
  <updated-at type="dateTime">2026-04-06T04:40:06Z</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>[2H]C(C1=CC2=C(OCO2)C=C1)C([2H])(C)NC([2H])([2H])[2H]</moldb-smiles>
  <moldb-formula>C11H10D5NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3/i2D3,5D,8D</moldb-inchi>
  <moldb-inchikey>SHXWCVYOXRDMCX-RMOCDOLISA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">198.277</moldb-average-mass>
  <moldb-mono-mass type="decimal">198.141662</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>27472395</chemspider-id>
  <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>CHEM117598</chemdb-id>
  <dsstox-id>DTXSID801016129</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00101026</susdat-id>
  <iupac>1-(2H-1,3-Benzodioxol-5-yl)-N-(~2~H_3_)methyl(1,2-~2~H_2_)propan-2-amine</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>Organoheterocyclic compounds</superklass>
  <klass>Benzodioxoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0121322</sync-id>
  <structure-inchikey>SHXWCVYOXRDMCX-RMOCDOLISA-N</structure-inchikey>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:45:01Z</structure-indexed-at>
</compound>
