<?xml version="1.0" encoding="UTF-8"?>
<metabolite>
  <version>1.0</version>
  <creation_date>2016-09-30 22:40:14 UTC</creation_date>
  <update_date>2020-04-22 15:06:26 UTC</update_date>
  <accession>BMDB0001039</accession>
  <secondary_accessions>
    <accession>BMDB01039</accession>
  </secondary_accessions>
  <name>Hydroxide</name>
  <description/>
  <synonyms>
    <synonym>HYDROXIDE ion</synonym>
    <synonym>OH(-)</synonym>
    <synonym>Hydroxyl ion</synonym>
    <synonym>Hydridooxygenate(1-)</synonym>
    <synonym>Hydrogen oxide</synonym>
    <synonym>Hydroxide anion</synonym>
    <synonym>Hydroxide ion(1-)</synonym>
    <synonym>Hydroxide(1-)</synonym>
    <synonym>Hydroxy</synonym>
    <synonym>Hydroxy anion</synonym>
    <synonym>Hydroxy ion</synonym>
    <synonym>Hydroxyl</synonym>
    <synonym>Hydroxyl anion</synonym>
    <synonym>Hydroxyl ion (OH1-)</synonym>
    <synonym>Hydroxyl radical</synonym>
    <synonym>Hydroxyl radicals</synonym>
    <synonym>OH</synonym>
    <synonym>Oxidanide</synonym>
    <synonym>Oxygen ion (O1-)</synonym>
    <synonym>Water ion(1-)</synonym>
  </synonyms>
  <chemical_formula>HO</chemical_formula>
  <average_molecular_weight>17.0073</average_molecular_weight>
  <monisotopic_moleculate_weight>17.002739654</monisotopic_moleculate_weight>
  <iupac_name>hydroxide</iupac_name>
  <traditional_iupac>hydroxide</traditional_iupac>
  <cas_registry_number>14280-30-9</cas_registry_number>
  <smiles>[OH-]</smiles>
  <inchi>InChI=1S/H2O/h1H2/p-1</inchi>
  <inchikey>XLYOFNOQVPJJNP-UHFFFAOYSA-M</inchikey>
  <taxonomy>
    <description> belongs to the class of inorganic compounds known as non-metal hydroxides. These are inorganic non-metallic compounds containing the hydroxide group as its largest oxoanion.</description>
    <kingdom>Inorganic compounds</kingdom>
    <super_class>Homogeneous non-metal compounds</super_class>
    <class>Non-metal oxoanionic compounds</class>
    <sub_class>Non-metal hydroxides</sub_class>
    <direct_parent>Non-metal hydroxides</direct_parent>
    <alternative_parents>
      <alternative_parent>Inorganic hydrides</alternative_parent>
      <alternative_parent>Inorganic oxides</alternative_parent>
    </alternative_parents>
    <substituents>
      <substituent>Inorganic hydride</substituent>
      <substituent>Inorganic oxide</substituent>
      <substituent>Non-metal hydroxide</substituent>
    </substituents>
    <molecular_framework/>
    <external_descriptors>
      <external_descriptor>an anion</external_descriptor>
      <external_descriptor>oxygen hydride</external_descriptor>
    </external_descriptors>
  </taxonomy>
  <experimental_properties>
    <state>Solid</state>
  </experimental_properties>
  <predicted_properties>
    <property>
      <kind>logp</kind>
      <value>-0.65</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_acidic</kind>
      <value>15.7</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>pka_strongest_basic</kind>
      <value>-1.8</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>iupac</kind>
      <value>hydroxide</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>average_mass</kind>
      <value>17.0073</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mono_mass</kind>
      <value>17.002739654</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>smiles</kind>
      <value>[OH-]</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formula</kind>
      <value>HO</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchi</kind>
      <value>InChI=1S/H2O/h1H2/p-1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>inchikey</kind>
      <value>XLYOFNOQVPJJNP-UHFFFAOYSA-M</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polar_surface_area</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>refractivity</kind>
      <value>13.91</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>polarizability</kind>
      <value>1.19</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rotatable_bond_count</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>acceptor_count</kind>
      <value>1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>donor_count</kind>
      <value>1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>physiological_charge</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>formal_charge</kind>
      <value>-1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>number_of_rings</kind>
      <value>0</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>bioavailability</kind>
      <value>1</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>rule_of_five</kind>
      <value>Yes</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>ghose_filter</kind>
      <value>Yes</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>veber_rule</kind>
      <value>Yes</value>
      <source>ChemAxon</source>
    </property>
    <property>
      <kind>mddr_like_rule</kind>
      <value>Yes</value>
      <source>ChemAxon</source>
    </property>
  </predicted_properties>
  <pathways>
  </pathways>
  <spectra>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>55734</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>55735</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>55736</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>110946</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>110947</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>110948</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2908677</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2908678</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2908679</spectrum_id>
    </spectrum>
  </spectra>
  <normal_concentrations>
  </normal_concentrations>
  <foodb_id>FDB022386</foodb_id>
  <pubchem_compound_id>961</pubchem_compound_id>
  <chemspider_id>936</chemspider_id>
  <kegg_id>C01328</kegg_id>
  <pdbe_id/>
  <drugbank_id/>
  <chebi_id>16234</chebi_id>
  <meta_cyc_id>OH</meta_cyc_id>
  <phenol_explorer_compound_id/>
  <knapsack_id>C00025875</knapsack_id>
  <bigg_id>37371</bigg_id>
  <wikipedia_id>Hydroxide</wikipedia_id>
  <metlin_id/>
  <synthesis_reference>Revzin, G. E.; Lavrent'eva, V. G.; Revzina, T. V.; Kashina, N. I.  Preparation of hydroxides slightly soluble in water.    U.S.S.R.  (1967),     CODEN: URXXAF  SU  196735  19670531  CAN 68:4526  AN 1968:4526</synthesis_reference>
  <general_references>
  </general_references>
  <protein_associations>
    <protein>
      <protein_accession>BMDBP00438</protein_accession>
      <name>Alpha-1-antiproteinase</name>
      <uniprot_id>P34955</uniprot_id>
      <gene_name>SERPINA1</gene_name>
      <protein_type>Enzyme</protein_type>
    </protein>
    <protein>
      <protein_accession>BMDBP00439</protein_accession>
      <name>Xylosyltransferase 2</name>
      <uniprot_id>Q5QQ49</uniprot_id>
      <gene_name>XYLT2</gene_name>
      <protein_type>Enzyme</protein_type>
    </protein>
  </protein_associations>
</metabolite>
