{
  "iri" : "http://purl.obolibrary.org/obo/CHEBI_18346",
  "lang" : "en",
  "description" : [ "A member of the class of benzaldehydes carrying methoxy and hydroxy substituents at positions 3 and 4 respectively." ],
  "synonyms" : [ "4-hydroxy-3-methoxybenzaldehyde", "Vanillin", "vanillin", "3-methoxy-4-hydroxybenzaldehyde", "4-Hydroxy-3-methoxy-benzaldehyde", "4-Hydroxy-3-methoxybenzaldehyde", "4-formyl-2-methoxyphenol", "4-hydroxy-3-methoxybenzaldehyde", "4-hydroxy-m-anisaldehyde", "Vanillaldehyde", "methylprotocatechuic aldehyde", "p-hydroxy-m-methoxybenzaldehyde", "p-vanillin", "vaniline", "vanillaldehyde", "vanillic aldehyde" ],
  "annotation" : {
    "charge" : [ "0" ],
    "formula" : [ "C8H8O3" ],
    "has_RxCUI" : [ "1368176" ],
    "has_alternative_id" : [ "CHEBI:15302", "CHEBI:1842", "CHEBI:20380", "CHEBI:48387" ],
    "has_dbxref" : [ "Beilstein:472792", "CAS:121-33-5", "FooDB:FDB000838", "Gmelin:3596", "HMDB:HMDB0012308", "KEGG:C00755", "KEGG:D00091", "KNApSAcK:C00002683", "KNApSAcK:C00029531", "MetaCyc:VANILLIN", "PDBeChem:V55", "PMCID:PMC7790484", "PMCID:PMC8235570", "PMID:18479250", "PMID:19238838", "PMID:19812218", "PMID:21417387", "PMID:21542597", "PMID:21846089", "PMID:22308371", "PMID:29950589", "PMID:31661600", "PMID:33477040", "PMID:33938405", "PMID:34013088", "PMID:34035660", "UM-BBD_compID:c0193", "Wikipedia:Vanillin" ],
    "has_obo_namespace" : [ "chebi_ontology" ],
    "id" : [ "CHEBI:18346" ],
    "inchi" : [ "InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3" ],
    "inchikey" : [ "MWOOGOJBHIARFG-UHFFFAOYSA-N" ],
    "mass" : [ "152.149" ],
    "monoisotopicmass" : [ "152.04734" ],
    "smiles" : [ "[H]C(=O)C1=CC(OC)=C(O)C=C1" ]
  },
  "label" : "vanillin",
  "ontology_name" : "dron",
  "ontology_prefix" : "DRON",
  "ontology_iri" : "http://purl.obolibrary.org/obo/dron.owl",
  "is_obsolete" : false,
  "term_replaced_by" : null,
  "is_defining_ontology" : false,
  "has_children" : false,
  "is_root" : false,
  "short_form" : "CHEBI_18346",
  "obo_id" : "CHEBI:18346",
  "in_subset" : [ "3_STAR" ],
  "obo_definition_citation" : null,
  "obo_xref" : [ {
    "database" : "Beilstein",
    "id" : "472792",
    "description" : "Beilstein",
    "url" : null
  }, {
    "database" : "CAS",
    "id" : "121-33-5",
    "description" : "NIST Chemistry WebBook",
    "url" : null
  }, {
    "database" : "CAS",
    "id" : "121-33-5",
    "description" : "ChemIDplus",
    "url" : null
  }, {
    "database" : "FooDB",
    "id" : "FDB000838",
    "description" : null,
    "url" : "http://foodb.ca/compounds/FDB000838"
  }, {
    "database" : "Gmelin",
    "id" : "3596",
    "description" : "Gmelin",
    "url" : null
  }, {
    "database" : "HMDB",
    "id" : "HMDB0012308",
    "description" : null,
    "url" : "http://www.hmdb.ca/metabolites/HMDB0012308"
  }, {
    "database" : "KEGG",
    "id" : "C00755",
    "description" : null,
    "url" : "http://www.kegg.jp/entry/C00755"
  }, {
    "database" : "KEGG",
    "id" : "D00091",
    "description" : null,
    "url" : "http://www.kegg.jp/entry/D00091"
  }, {
    "database" : "KNApSAcK",
    "id" : "C00002683",
    "description" : null,
    "url" : "http://www.knapsackfamily.com/knapsack_core/information.php?word=C00002683"
  }, {
    "database" : "KNApSAcK",
    "id" : "C00029531",
    "description" : null,
    "url" : "http://www.knapsackfamily.com/knapsack_core/information.php?word=C00029531"
  }, {
    "database" : "MetaCyc",
    "id" : "VANILLIN",
    "description" : null,
    "url" : "https://biocyc.org/META/NEW-IMAGE?type=NIL&object=VANILLIN"
  }, {
    "database" : "PDBeChem",
    "id" : "V55",
    "description" : null,
    "url" : "https://www.ebi.ac.uk/pdbe-srv/pdbechem/chemicalCompound/show/V55"
  }, {
    "database" : "PMCID",
    "id" : "PMC7790484",
    "description" : "Europe PMC",
    "url" : "https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7790484"
  }, {
    "database" : "PMCID",
    "id" : "PMC8235570",
    "description" : "Europe PMC",
    "url" : "https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8235570"
  }, {
    "database" : "PMID",
    "id" : "18479250",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/18479250"
  }, {
    "database" : "PMID",
    "id" : "19238838",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/19238838"
  }, {
    "database" : "PMID",
    "id" : "19812218",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/19812218"
  }, {
    "database" : "PMID",
    "id" : "21417387",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/21417387"
  }, {
    "database" : "PMID",
    "id" : "21542597",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/21542597"
  }, {
    "database" : "PMID",
    "id" : "21846089",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/21846089"
  }, {
    "database" : "PMID",
    "id" : "22308371",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/22308371"
  }, {
    "database" : "PMID",
    "id" : "29950589",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/29950589"
  }, {
    "database" : "PMID",
    "id" : "31661600",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/31661600"
  }, {
    "database" : "PMID",
    "id" : "33477040",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/33477040"
  }, {
    "database" : "PMID",
    "id" : "33938405",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/33938405"
  }, {
    "database" : "PMID",
    "id" : "34013088",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/34013088"
  }, {
    "database" : "PMID",
    "id" : "34035660",
    "description" : "Europe PMC",
    "url" : "http://www.ncbi.nlm.nih.gov/pubmed/34035660"
  }, {
    "database" : "UM-BBD_compID",
    "id" : "c0193",
    "description" : "UM-BBD",
    "url" : null
  }, {
    "database" : "Wikipedia",
    "id" : "Vanillin",
    "description" : null,
    "url" : "http://en.wikipedia.org/wiki/Vanillin"
  } ],
  "obo_synonym" : [ {
    "name" : "4-hydroxy-3-methoxybenzaldehyde",
    "scope" : "hasExactSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "IUPAC",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "Vanillin",
    "scope" : "hasExactSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "KEGG_COMPOUND",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "vanillin",
    "scope" : "hasExactSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "UniProt",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "3-methoxy-4-hydroxybenzaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "UM-BBD",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "4-Hydroxy-3-methoxy-benzaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "KEGG_COMPOUND",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "4-Hydroxy-3-methoxybenzaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "KEGG_COMPOUND",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "4-formyl-2-methoxyphenol",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "4-hydroxy-3-methoxybenzaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "4-hydroxy-m-anisaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "NIST_Chemistry_WebBook",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "Vanillaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "KEGG_COMPOUND",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "methylprotocatechuic aldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "p-hydroxy-m-methoxybenzaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "NIST_Chemistry_WebBook",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "p-vanillin",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "NIST_Chemistry_WebBook",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "vaniline",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChEBI",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "vanillaldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  }, {
    "name" : "vanillic aldehyde",
    "scope" : "hasRelatedSynonym",
    "type" : null,
    "xrefs" : [ {
      "database" : null,
      "id" : "ChemIDplus",
      "description" : null,
      "url" : null
    } ]
  } ],
  "is_preferred_root" : false,
  "_links" : {
    "self" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346?lang=en"
    },
    "parents" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/parents"
    },
    "ancestors" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/ancestors"
    },
    "hierarchicalParents" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/hierarchicalParents"
    },
    "hierarchicalAncestors" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/hierarchicalAncestors"
    },
    "jstree" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/jstree"
    },
    "graph" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/graph"
    },
    "has_role" : {
      "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/dron/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_18346/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FRO_0000087"
    }
  }
}