<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">345435</id>
  <title nil="true"/>
  <common-name>Methyl (1s,5s,11r,14s,15s,17r,18s,19s,21r)-21-hydroxy-10,10,14,17,18,21-hexamethyl-8,20-dioxo-2,3,9,22-tetraoxapentacyclo[13.6.1.01,17.05,11.05,15]docosane-19-carboxylate</common-name>
  <description>Methyl (1s,5s,11r,14s,15s,17r,18s,19s,21r)-21-hydroxy-10,10,14,17,18,21-hexamethyl-8,20-dioxo-2,3,9,22-tetraoxapentacyclo[13.6.1.01,17.05,11.05,15]docosane-19-carboxylate is a chemical compound with the formula C26H38O9. It has an average molecular weight of 494.60 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>155818803</pubchem-id>
  <chemical-formula>C26H38O9</chemical-formula>
  <weight>494.6</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">2026-08-31T08:11:11Z</created-at>
  <updated-at type="dateTime">2026-08-31T08:11:11Z</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>CC1CCC2C(OC(=O)CCC23C14CC5(C(C(C(=O)C(C5(O4)OOC3)(C)O)C(=O)OC)C)C)(C)C</moldb-smiles>
  <moldb-formula>C26H38O9</moldb-formula>
  <moldb-inchi>InChI=1S/C26H38O9/c1-14-8-9-16-21(3,4)33-17(27)10-11-24(16)13-32-35-26-22(5,12-25(14,24)34-26)15(2)18(20(29)31-7)19(28)23(26,6)30/h14-16,18,30H,8-13H2,1-7H3/t14-,15-,16-,18-,22+,23+,24+,25-,26-/m0/s1</moldb-inchi>
  <moldb-inchikey>FKVSHWDGJOLCOC-QLDZKYQNSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">494.2515828</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.6</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>CHEM341328</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>Methyl (1s,5s,11r,14s,15s,17r,18s,19s,21r)-21-hydroxy-10,10,14,17,18,21-hexamethyl-8,20-dioxo-2,3,9,22-tetraoxapentacyclo[13.6.1.01,17.05,11.05,15]docosane-19-carboxylate</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>Lactones</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0295793</sync-id>
  <structure-inchikey>FKVSHWDGJOLCOC-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>220000000000000000000000000000000000000880000000800200000000000000802200200000000000000000000000000000000000002000820000000020000000000100010000000000000208000000011800000000800000000000000000100000000400000000000000200400200000000002000400080011000000000480000000000000000000000a0200000000000008080000000000020200200040004000000000000080000000000800800002000000000000000000000000000000000000000000000000000000004000000000020201000000000000000000000000010000000000020000400000000000008000000000000200200</structure-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T05:44:29Z</structure-indexed-at>
</compound>
