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  <id type="integer">37305</id>
  <title nil="true"/>
  <common-name>Lacto-N-fucopentaose I</common-name>
  <description>Lacto-N-fucopentaose I (C32H55NO25) is a chemical compound found in or released from one recorded source: Electrical &amp; Electronic Equipment (Antennas). Lacto-N-fucopentaose I belongs to the carbohydrates and carbohydrate conjugates, a subclass of organooxygen compounds within the organic compounds. With an average molecular weight of 853.77 g/mol, Lacto-N-fucopentaose I is a heavy molecule.</description>
  <cas>7578-25-8</cas>
  <pubchem-id>53477883</pubchem-id>
  <chemical-formula>C32H55NO25</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">2016-05-26T07:18:45Z</created-at>
  <updated-at type="dateTime">2026-04-06T12:45:56Z</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>C[C@@H]1O[C@@H](OC2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2OC2[C@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]([C@H](O)CO)[C@H](O)[C@@H](O)C=O)[C@@H]3O)[C@@H]2NC(C)=O)[C@@H](O)[C@H](O)[C@@H]1O</moldb-smiles>
  <moldb-formula>C32H55NO25</moldb-formula>
  <moldb-inchi>InChI=1S/C32H55NO25/c1-8-16(42)21(47)23(49)30(51-8)58-28-22(48)18(44)12(5-36)54-32(28)56-26-15(33-9(2)39)29(52-13(6-37)19(26)45)57-27-20(46)14(7-38)53-31(24(27)50)55-25(11(41)4-35)17(43)10(40)3-34/h3,8,10-32,35-38,40-50H,4-7H2,1-2H3,(H,33,39)/t8-,10-,11+,12+,13+,14+,15+,16+,17+,18-,19+,20-,21+,22-,23-,24+,25+,26?,27-,28?,29-,30-,31-,32-/m0/s1</moldb-inchi>
  <moldb-inchikey>DTVXXTISAIGIBA-GZPGEGJMSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">853.7708</moldb-average-mass>
  <moldb-mono-mass type="decimal">853.306316315</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>CHEM036200</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00124521</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>423.46000000000004</moldb-polar-surface-area>
  <moldb-refractivity>176.55640000000008</moldb-refractivity>
  <moldb-polarizability>80.06611098336651</moldb-polarizability>
  <moldb-rotatable-bond-count>17</moldb-rotatable-bond-count>
  <moldb-acceptor-count>25</moldb-acceptor-count>
  <moldb-donor-count>16</moldb-donor-count>
  <moldb-pka-strongest-acidic>11.423192455640555</moldb-pka-strongest-acidic>
  <moldb-pka-strongest-basic>-3.676506702989518</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>4</moldb-number-of-rings>
  <moldb-alogps-logp>-2.21</moldb-alogps-logp>
  <moldb-alogps-logs>-0.91</moldb-alogps-logs>
  <moldb-alogps-solubility>1.04e+02 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic oxygen compounds</superklass>
  <klass>Organooxygen compounds</klass>
  <subklass>Carbohydrates and carbohydrate conjugates</subklass>
  <paper-count type="integer">433</paper-count>
  <sync-id>CED0011705</sync-id>
  <structure-inchikey>DTVXXTISAIGIBA-GZPGEGJMSA-N</structure-inchikey>
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  <structure-indexed-at type="dateTime">2026-09-19T04:11:13Z</structure-indexed-at>
</compound>
