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<compound>
  <id type="integer">2892</id>
  <title>T3D2850</title>
  <common-name>Pentazocine</common-name>
  <description>Pentazocine is an exogenous solid with the formula C19H27NO and an average molecular weight of 285.42 g/mol. Pentazocine belongs to the 2,6-dimethyl-3-benzazocines, a subclass of 6,7-benzomorphans within the organic compounds. This compound is recorded as being found in or released from five sources: analgesics within healthcare, pharmaceuticals, and veterinary products; non-electric simulated smoking devices and other smoking requisites within household cleaning and consumer products; and antennas and radio transmission systems within electrical and electronic equipment. Recorded exposure routes include intramuscular, intravenous, oral, and subcutaneous administration.

The compound interacts with four recorded protein targets: the mu-type opioid receptor (OPRM1), kappa-type opioid receptor (OPRK1), sigma non-opioid intracellular receptor 1 (SIGMAR1), and delta-type opioid receptor (OPRD1). The preponderance of evidence suggests that pentazocine antagonizes the opioid effects by competing for the same receptor sites, especially the opioid mu receptor.</description>
  <cas>359-83-1</cas>
  <pubchem-id>441278</pubchem-id>
  <chemical-formula>C19H27NO</chemical-formula>
  <weight>285.209260</weight>
  <appearance>White powder.</appearance>
  <melting-point>146.3°C</melting-point>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility>1.22e-01 g/L</solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure>Intravenous, Oral. Well absorbed from the gastro-intestinal tract.</route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity>The preponderance of evidence suggests that pentazocine antagonizes the opioid effects by competing for the same receptor sites, especially the opioid mu receptor.</mechanism-of-toxicity>
  <metabolism>HepaticHalf Life: 2 to 3 hours</metabolism>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>Used to treat mild to moderately severe pain. [Wikipedia] </use-source>
  <min-risk-level nil="true"/>
  <health-effects>Medical problems can include congested lungs, liver disease, tetanus, cardiovascular effects, infection of the heart valves, skin abscesses, anemia and pneumonia. Death can occur from overdose.</health-effects>
  <symptoms>hallucinations and other psychotomimetic effects; cardiovascular effects</symptoms>
  <treatment>Adequate measures to maintain ventilation and general circulatory support should be employed. Assisted or controlled ventilation, intravenous fluids, vasopressors, and other supportive measures should be employed as indicated. Consideration should be given to gastric lavage and gastric aspiration. For respiratory depression due to overdosage or unusual sensitivity to pentazocine, parenteral naloxone is a specific and effective antagonist. Initial doses of 0.4 to 2.0 mg of naloxone are recommended, repeated at 2-3 minute intervals, if needed, up to a total of 10 mg. Anti</treatment>
  <created-at type="dateTime">2009-07-21T20:27:20Z</created-at>
  <updated-at type="dateTime">2026-05-14T16:45:07Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia>Pentazocine</wikipedia>
  <uniprot-id></uniprot-id>
  <kegg-compound-id>C07421</kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id>116117</chebi-id>
  <biocyc-id></biocyc-id>
  <ctd-id nil="true"/>
  <stitch-id>Pentazocine</stitch-id>
  <drugbank-id>DB00652</drugbank-id>
  <pdb-id></pdb-id>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>C[C@H]1[C@H]2CC3=CC=C(O)C=C3[C@]1(C)CCN2CC=C(C)C</moldb-smiles>
  <moldb-formula>C19H27NO</moldb-formula>
  <moldb-inchi>InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m0/s1</moldb-inchi>
  <moldb-inchikey>VOKSWYLNZZRQPF-GDIGMMSISA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">285.4238</moldb-average-mass>
  <moldb-mono-mass type="decimal">285.209264491</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp>4.64</logp>
  <hmdb-id>HMDB14790</hmdb-id>
  <chembl-id>CHEMBL560</chembl-id>
  <chemspider-id>390041</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></synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM002239</chemdb-id>
  <dsstox-id>DTXSID7023433</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>1,13-dimethyl-10-(3-methylbut-2-en-1-yl)-10-azatricyclo[7.3.1.0^{2,7}]trideca-2(7),3,5-trien-4-ol</iupac>
  <moldb-polar-surface-area>23.47</moldb-polar-surface-area>
  <moldb-refractivity>89.7993</moldb-refractivity>
  <moldb-polarizability>33.86191659961722</moldb-polarizability>
  <moldb-rotatable-bond-count>2</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>1</moldb-donor-count>
  <moldb-pka-strongest-acidic>7.590926857289439</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>12.401294420402692</moldb-pka-strongest-basic>
  <moldb-physiological-charge>1</moldb-physiological-charge>
  <moldb-number-of-rings>3</moldb-number-of-rings>
  <moldb-alogps-logp>4.44</moldb-alogps-logp>
  <moldb-alogps-logs>-3.37</moldb-alogps-logs>
  <moldb-alogps-solubility>1.22e-01 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Alkaloids and derivatives</superklass>
  <klass>6,7-benzomorphans</klass>
  <subklass>2,6-dimethyl-3-benzazocines</subklass>
  <paper-count type="integer">3141</paper-count>
  <sync-id>CED0004344</sync-id>
  <structure-inchikey>VOKSWYLNZZRQPF-GDIGMMSISA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:00:36Z</structure-indexed-at>
</compound>
