<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">97913</id>
  <title nil="true"/>
  <common-name>3,7,11-Tris(2-hydroxyethyl)-15-oxa-3,7,11-triazaheptacosane-1,13-diol hydrochloride</common-name>
  <description>3,7,11-Tris(2-hydroxyethyl)-15-oxa-3,7,11-triazaheptacosane-1,13-diol hydrochloride belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. With an average molecular weight of 586.30 g/mol, 3,7,11-Tris(2-hydroxyethyl)-15-oxa-3,7,11-triazaheptacosane-1,13-diol hydrochloride is a heavy molecule. It has the chemical formula C29H63N3O6.</description>
  <cas>82799-33-5</cas>
  <pubchem-id>44153927</pubchem-id>
  <chemical-formula>C29H63N3O6</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">2026-04-05T05:36:30Z</created-at>
  <updated-at type="dateTime">2026-04-05T05:36:30Z</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>Cl.CCCCCCCCCCCCOCC(O)CN(CCO)CCCN(CCO)CCCN(CCO)CCO</moldb-smiles>
  <moldb-formula>C29H63N3O6</moldb-formula>
  <moldb-inchi>InChI=1/C29H63N3O6.ClH/c1-2-3-4-5-6-7-8-9-10-11-26-38-28-29(37)27-32(21-25-36)17-13-15-30(18-22-33)14-12-16-31(19-23-34)20-24-35;/h29,33-37H,2-28H2,1H3;1H</moldb-inchi>
  <moldb-inchikey>XQKBJAQHPXPUIJ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">586.3</moldb-average-mass>
  <moldb-mono-mass type="decimal">549.4716867</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>CHEM093806</chemdb-id>
  <dsstox-id>DTXSID901002898</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00060359</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 nitrogen compounds</superklass>
  <klass>Organonitrogen compounds</klass>
  <subklass>Amines</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0128673</sync-id>
  <structure-inchikey>XQKBJAQHPXPUIJ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40040008000000000000800000000200000000000000000000000002100002100000000002000000000000000000000000000010000000000000004000000000000000000000000000010000000000008000000000000100000000000000000000000020010000000000000002004000000000000000000002000000000000000000000040000000000000000000010000000800000000000000000040000000000000000004000000000000000000000000000008000000000000000000000020000000000400000000000000000000000000000000000000000004000000000000000000000000080000000000010000000001000000000080000000000200</structure-fingerprint>
  <structure-pattern-fingerprint>400080000512020001001100813820000000000884052000003000400200080c4002005000800000000041000080000004600205008c10210004643000a00000c6110400008000000080100000720000000400004001003240000422040001000c200128004002000000000055340004200080500101a1041118000002500002504000080ee0800808020250082c0008311c08124400940a1000082020400000804310110090c00000000860016c35104ac00000880108001000080040400200001000840408002200800400000102900800000002004000096000000800020400004800088100001000000008022004005000308042840c0000010050000002</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������'���%���€���@������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`����������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T04:37:49Z</structure-indexed-at>
</compound>
