<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">277228</id>
  <title nil="true"/>
  <common-name>[[hydroxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stibinic acid</common-name>
  <description>[[hydroxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stibinic acid is a compound with the formula C36H50N3O22Sb3. With an average molecular weight of 1,242 g/mol, [[hydroxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stibinic acid is a heavy molecule.</description>
  <cas nil="true"/>
  <pubchem-id>16683100</pubchem-id>
  <chemical-formula>C36H50N3O22Sb3</chemical-formula>
  <weight>1242.1</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">2026-08-26T17:02:35Z</created-at>
  <updated-at type="dateTime">2026-08-26T17:02:35Z</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>C1=CC(=CC=C1NC2C(C(C(C(O2)CO)O)O)O)[Sb](=O)(O)O[Sb](=O)(C3=CC=C(C=C3)NC4C(C(C(C(O4)CO)O)O)O)O[Sb](=O)(C5=CC=C(C=C5)NC6C(C(C(C(O6)CO)O)O)O)O</moldb-smiles>
  <moldb-formula>C36H50N3O22Sb3</moldb-formula>
  <moldb-inchi>InChI=1S/3C12H16NO5.2H2O.5O.3Sb/c3*14-6-8-9(15)10(16)11(17)12(18-8)13-7-4-2-1-3-5-7;;;;;;;;;;/h3*2-5,8-17H,6H2;2*1H2;;;;;;;;/q;;;;;;;;;;;2*+1/p-2/t3*8-,9-,10+,11-,12-;;;;;;;;;;/m111........../s1</moldb-inchi>
  <moldb-inchikey>COYXHTQLYJNUGB-VZUYEAPTSA-L</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">1239.00003</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>CHEM273121</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>[[hydroxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stiboryl]oxy-[4-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]stibinic acid</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 nil="true"/>
  <superklass nil="true"/>
  <klass nil="true"/>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0229392</sync-id>
  <structure-inchikey>COYXHTQLYJNUGB-UHFFFAOYSA-L</structure-inchikey>
  <structure-fingerprint>40020800000000000000000000001000100000002000000000000000000000000000000000000000000000000080000000000800000080000000080000000000000000000201000000020800000000100000000000000000000200000010020000010000000004000000000000040000000000000000000100104000000000000000000000000000080000000000000000010200000400000000000000000000000000000080000000000000000000800000104000008000000000000000004000000000000000000000000000000000000000200080000000020000000000800000040000008000040000000000000000000200000000000</structure-fingerprint>
  <structure-pattern-fingerprint>7014c4408f32c278c9ec5b6583b8a2899a1014ba859fa070853d20f48b34ea4c6c6201521380046c870b492840cd212015e00b24539f7235396e7d3980e24016c7119c895a803420829013c21af322002804c5c971619fb751165d6244225397eca8652f086c1230418cc680ddf4004c78869252a149e5a6f15b244503f99b87d04d39884ef8a26a0c170254c8ad02a83b1dda12456e9e0a70230ca166c007c403d7139731b2c2b05a844d680b7d35144ad90c4389490ac050b04ab0cce09252a78112b4d5dbd33b5dc0a4a2771542990c612814236070638d7156886e20530c91385db418890b6dd36c2441d916a08e4a50163591c2840f13199b82da0a060a</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������@���E���€��@h�������@h�������@(������@h�������@h�������@(�������h��������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�����3  ������(�������`������� ����3  ������(������@(������@h�������@h�������@(������@h�������@h��������h��������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`������� ����3  ������(������@(������@h�������@h�������@(������@h�������@h��������h��������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`��������h���h���h���h���h��� �������	�	
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����������� !"#$��./012-�567894����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:52:57Z</structure-indexed-at>
</compound>
