Consensus flow list

Oxolinic Acid

fo-19f2f4a227bf159a

Identity

Type
Neutral molecule
CAS
14698-29-4
EC
238-750-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Oxolinic Acid

Alternative labels

31

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string KYGZCKSPAKDVKC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)
IUPAC name chemrof:IUPAC_name Oxolinic Acid
Molecular formula chemrof:molecular_formula C13H11NO5
Molecular mass chemrof:molecular_mass 261.233
Monoisotopic mass chemrof:monoisotopic_mass 261.06372, 261.063722
SMILES string chemrof:smiles_string CCn1cc(C(=O)O)c(=O)c2cc3c(cc21)OCO3

Known URLs

44

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=14698-29-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:138856 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.035.213 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1021089 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB13627 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2024 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2024 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=110364 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=758177 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL416755 enrich_references.pubchem_identifier_url
gmelin gmelin:2609419 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/L0A22B22FT enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0255996 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J8.514F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C11342 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D02301 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C11342 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D02301 enrich_references.pubchem_identifier_url
lincs.smallmolecule lincs.smallmolecule:LSM-5811 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=52726 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C76921 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C795 enrich_references.pubchem_identifier_url
patent patent:US3287458 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:OXI enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL416755 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/4628 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=001990 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/1245092 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/1650428 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19596082 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/20151406 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22670590 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23353085 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23773949 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23816421 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/26678217 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/26920300 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/29438107 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/4616804 enrich_references.chebi_xrefs
reaxys reaxys:620635 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/7798 enrich_references.pubchem_identifier_url
vsdb vsdb:1879 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q287840 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Oxolinic_acid enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
2b5d5f57-446d-4170-a829-c472244d73ae Environmental → Air → Aircraft cruise height EF 3.1 kg 4
4b4f9b74-4cbf-4d5e-b9b5-f15bdccdcbb4 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2db25b03-a210-4632-bd21-8533ad4b181f Environmental → Air → Indoor EF 3.1 kg 4
10dbf2c1-55e9-4af9-a039-7f36c26a4b0e Environmental → Air → Long-term EF 3.1 kg 0
58c95132-12f2-44cd-8d17-225fef18774c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
bedfb554-d6e2-4aae-abf0-063bd18ffab7 Environmental → Air → Unknown EF 3.1 kg 4
9ec311c3-4792-4775-9645-8ca008f765f8 Environmental → Ground → Agricultural EF 3.1 kg 4
35dbce37-4ec4-42a7-bff0-2652ddaa10e9 Environmental → Ground → Non-agricultural EF 3.1 kg 4
c1801dd9-6b25-4fef-bbb6-00055e8f4060 Environmental → Ground → Unknown EF 3.1 kg 4
7948336c-9000-441f-a9d3-ed82bef2a537 Environmental → Water → Long-term EF 3.1 kg 0
78531d46-ea9c-44d4-9185-f0c7345b80e4 Environmental → Water → Ocean EF 3.1 kg 4
39f074af-0db7-4f5c-a298-0d5a48084442 Environmental → Water → Surface water EF 3.1 kg 4
313dfb16-8206-4001-8f3a-9d3f2824cf3d Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-19f2f4a227bf159a",
  "prefLabel": [
    {
      "@value": "Oxolinic Acid",
      "@language": "en",
      "@lang": "en",
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  ],
  "altLabel": [
    {
      "@value": "1,3-Dioxolo[4,5-g]quinoline-7-carboxylic acid, 5-ethyl-5,8-dihydro-8-oxo-",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Ethyl-1,4-dihydro-6,7-methylenedioxy-4-oxo-3-quinolinecarboxylic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1-Ethyl-6,7-methylenedioxy-4-quinolone-3-carboxylic acid",
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      }
    },
    {
      "@value": "5-Ethyl-5,8-dihydro-8-oxo-1,3-dioxolo(4,5-g)quinoline-7-carboxylic acid",
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      }
    },
    {
      "@value": "5-Ethyl-5,8-dihydro-8-oxo-1,3-dioxolo[4,5-g]quinoline-7-carboxylic acid",
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      }
    },
    {
      "@value": "5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxylic acid",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "acide oxolinique",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "acido oxolinico",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "acidum oxolinicum",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Dioxacin",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Emyrenil",
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      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Gramurin",
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      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Inoxyl",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "MeSH ID: D010093",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nidantin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "OA",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "http://purl.obolibrary.org/obo/CHEBI_138856"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Ossian",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Oxoboi",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pietil",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Prodoxal",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Prodoxol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Starner",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Starner 20WP",
      "@language": "en",
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      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ultibid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Urinox",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Uritrate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Uro-Alvar",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:14698-29-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Urotrate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Uroxin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Uroxol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Utibid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=14698-29-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C13H11NO5"
      ],
      "attested_by": {
        "C13H11NO5": [
          "enrich_references.chebi_semantic",
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
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