<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2026-03-31 20:49:22 UTC</creation_date>
  <update_date>2026-05-20 19:28:10 UTC</update_date>
  <accession/>
  <common_name>Angustmycin A</common_name>
  <class>SmallMolecule</class>
  <description>Angustmycin A is an organoheterocyclic compound with the formula C11H13N5O4 and an average molecular weight of 279.26 g/mol. Angustmycin A belongs to the purines and purine derivatives, a subclass of imidazopyrimidines within the organic compounds. This compound is found in or released from one recorded source: healthcare, pharmaceuticals &amp; veterinary products, specifically antibiotics. Recorded exposure routes for the substance include inhalation and oral administration.</description>
  <categories/>
  <types/>
  <synonyms>
    <synonym>(2R,3R,4S)-2-(6-amino-9H-purin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol</synonym>
    <synonym>(2R,3R,4S)-2-(6-aminopurin-9-yl)-2-(hydroxymethyl)-5-methylideneoxolane-3,4-diol</synonym>
    <synonym>08/04/2004</synonym>
    <synonym>2-(6-Amino-9H-purin-9-yl)-6-deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl</synonym>
    <synonym>4',5'-didehydro-1'-C-(hydroxymethyl)-adenosine</synonym>
    <synonym>9-(6-Deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl)-9H-purin-6-amine</synonym>
    <synonym>9-(6-Deoxy-beta-D-erythro-hex-5-enulofuranosyl)adenine</synonym>
    <synonym>9-(Tetrahydro-3,4-dihydroxy-2-(hydroxymethyl)-5-methylene-2-furyl)adenine</synonym>
    <synonym>9H-Purin-6-amine, 9-(6-deoxy-beta-D-erythro-hex-5-en-2-ulofuranosyl)-</synonym>
    <synonym>Adenine, 9-(6-deoxy-beta-D-erythro-hex-5-enulofuranosyl)-</synonym>
    <synonym>Adenine, 9-(tetrahydro-3,4-dihydroxy-2-(hydroxymethyl)-5-methylene-2-furyl)-</synonym>
    <synonym>Angustmycin A</synonym>
    <synonym>Angustomycin A</synonym>
    <synonym>Antibiotic A 14</synonym>
    <synonym>beta-D-erythro-Hex-5-en-2-ulofuranosyl, 2-(6-amino-9H-purin-9-yl)-6-deoxy-</synonym>
    <synonym>Decomycin, U-7984, AI3-50816, Angustmycin A</synonym>
    <synonym>Decoyinin</synonym>
    <synonym>Decoyinine</synonym>
  </synonyms>
  <chemical_formula>C11H13N5O4</chemical_formula>
  <average_molecular_weight>279.256</average_molecular_weight>
  <monisotopic_moleculate_weight>279.096754</monisotopic_moleculate_weight>
  <iupac_name/>
  <traditional_iupac/>
  <cas_registry_number>2004-04-8;21735-70-6;1373-27-9</cas_registry_number>
  <smiles>NC1=C2N=CN(C2=NC=N1)[C@]1(CO)OC(=C)[C@@H](O)[C@H]1O</smiles>
  <inchi>InChI=1S/C11H13N5O4/c1-5-7(18)8(19)11(2-17,20-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-4,7-8,17-19H,1-2H2,(H2,12,13,14)/t7-,8-,11-/m1/s1</inchi>
  <inchikey>UZSSGAOAYPICBZ-SOCHQFKDSA-N</inchikey>
  <taxonomy>
    <kingdom/>
    <super_class/>
    <class/>
    <sub_class/>
    <direct_parent/>
    <alternate_parents/>
    <substituents/>
    <molecular_framework/>
    <descriptors/>
  </taxonomy>
  <status>Detected and Not Quantified</status>
  <origin/>
  <cellular_locations/>
  <biofluid_locations/>
  <tissue_locations/>
  <pathways/>
  <state/>
  <appearance/>
  <experimental_properties/>
  <predicted_properties>
    <property>
      <kind>average_mass</kind>
      <value>279.256</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>279.096754</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>NC1=C2N=CN(C2=NC=N1)[C@]1(CO)OC(=C)[C@@H](O)[C@H]1O</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>C11H13N5O4</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/C11H13N5O4/c1-5-7(18)8(19)11(2-17,20-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-4,7-8,17-19H,1-2H2,(H2,12,13,14)/t7-,8-,11-/m1/s1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>UZSSGAOAYPICBZ-SOCHQFKDSA-N</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <route_of_exposure/>
  <mechanism_of_toxicity/>
  <metabolism/>
  <toxicity/>
  <lethaldose/>
  <carcinogenicity/>
  <use_source/>
  <min_risk_level/>
  <health_effects>#&lt;HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bf3471d60&gt;</health_effects>
  <symptoms/>
  <treatment/>
  <drugbank_id/>
  <hmdb_id/>
  <pubchem_compound_id>121578</pubchem_compound_id>
  <chembl_id/>
  <chemspider_id>108484</chemspider_id>
  <kegg_id/>
  <uniprot_id/>
  <omim_id/>
  <chebi_id/>
  <biocyc_id/>
  <ctd_id/>
  <stitch_id/>
  <actor_id/>
  <pdb_id/>
  <wikipidia/>
  <general_references/>
  <targets>
    <target>
      <target_id/>
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  </targets>
</compound>
