Consensus flow list

Identity

Type
Neutral molecule
CAS
142-08-5
EC
205-520-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 2-pyridone

Alternative labels

17

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string UBQKCCHYAOITMY-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)
IUPAC name chemrof:IUPAC_name 2-pyridone
Molecular formula chemrof:molecular_formula C5H5NO
Molecular mass chemrof:molecular_mass 95.101
Monoisotopic mass chemrof:monoisotopic_mass 95.03711, 95.037114
SMILES string chemrof:smiles_string O=c1cccc[nH]1

Known URLs

24

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=142-08-5 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=72762-00-6 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:16540 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.005.019 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.069.819 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2051716 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=172522 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=176167 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL662 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6770O3A2I5 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0013751 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J13.556I enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C02502 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C02502 enrich_references.pubchem_identifier_url
knapsack knapsack:C00007405 enrich_references.chebi_xrefs
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=42491 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/8871 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=081857 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=167209 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/10952545 enrich_references.chebi_xrefs
reaxys reaxys:105786 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q209474 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q72504024 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/2-pyridone enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
acdea366-4fbd-443d-8daf-3504e9d0b63b Environmental → Air → Aircraft cruise height EF 3.1 kg 2
d31af079-3d6d-476c-9ebb-f38a09ff34bb Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
d6c7ddc6-7307-4921-9115-d8f6a4527ab3 Environmental → Air → Indoor EF 3.1 kg 2
5d30f079-a601-42d9-bafd-0b3086438011 Environmental → Air → Long-term EF 3.1 kg 0
6ddec001-39fe-453b-950c-6d27a6f892b0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
0efd0e63-34f8-4ab0-93ab-fa02395a27f0 Environmental → Air → Unknown EF 3.1 kg 2
50ec9acb-15c5-4a76-9e23-f5654547be0c Environmental → Ground → Agricultural EF 3.1 kg 2
b03bb837-f0d2-4fbb-888a-f2ac3c6fa747 Environmental → Ground → Non-agricultural EF 3.1 kg 2
13d94654-874e-47da-a95a-48f09449c4aa Environmental → Ground → Unknown EF 3.1 kg 2
7f14e699-17a4-43ba-9684-797bf05bcdca Environmental → Water → Long-term EF 3.1 kg 0
25618204-34cc-4922-a300-0ae41cc96d26 Environmental → Water → Ocean EF 3.1 kg 2
629d1448-ec4d-450a-a523-1b12e5534892 Environmental → Water → Surface water EF 3.1 kg 2
808aa1c7-e4d3-4a42-abc0-f97b397265b1 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-f017f7bb164e995f",
  "prefLabel": [
    {
      "@value": "2-pyridone",
      "@language": "en",
      "@lang": "en",
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        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,2-Dihydro-2-oxopyridine",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=142-08-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,2-Dihydropyridin-2-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=142-08-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1H-2-Pyridone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1H-Pyridin-2-one",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2(1H)-Pyridinone",
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          "https://commonchemistry.cas.org/detail?cas_rn=142-08-5"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2(1H)-Pyridone",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Hydroxypyridine",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-Oxopyridine",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Pyridinol",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
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        ],
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      }
    },
    {
      "@value": "2-Pyridol",
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    },
    {
      "@value": "Pyridin-2(1H)-one",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "pyridin-2-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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    },
    {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Pyridine-2(1H)-one",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "α-Hydroxypyridine",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "α-Pyridone",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C5H5NO"
      ],
      "attested_by": {
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          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
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      },
      "rdfs:label": "Molecular formula",
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        },
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          "prov:hadPrimarySource": [
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    },
    "https://w3id.org/chemrof/smiles_string": {
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
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    },
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    },
    "https://w3id.org/chemrof/elemental_charge": {
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      ],
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  },
  "references": [
    {
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