Consensus flow list

Identity

Type
Neutral molecule
CAS
22131-79-9
EC
244-795-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Alclofenac

Alternative labels

24

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ARHWPKZXBHOEEE-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C11H11ClO3/c1-2-5-15-10-4-3-8(6-9(10)12)7-11(13)14/h2-4,6H,1,5,7H2,(H,13,14)
IUPAC name chemrof:IUPAC_name 3-Chloro-4-(2-propenyloxy)benzeneacetic acid
Molecular formula chemrof:molecular_formula C11H11ClO3
Molecular mass chemrof:molecular_mass 226.659
Monoisotopic mass chemrof:monoisotopic_mass 226.03967, 226.039672
SMILES string chemrof:smiles_string C=CCOc1ccc(CC(=O)O)cc1Cl

Known URLs

46

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=22131-79-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:31183 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.040.709 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4020038 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB13167 enrich_references.pubchem_identifier_url
drugcentral drugcentral:107 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/107 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL94081 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/M9CP5H21N8 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0248119 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.154B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D01252 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/D01252 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=54351 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C174701 enrich_references.pubchem_identifier_url
patent patent:BE704368 enrich_references.chebi_xrefs
pharos.nih.gov https://pharos.nih.gov/ligands/56UU677KJ2QT enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL94081 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/30951 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/18796 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19205 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/21068 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/236805 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/237493 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241593 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241595 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241596 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241597 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241598 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241600 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241601 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241602 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/241603 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24426 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/4279126 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/509935 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6103793 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6106453 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6109575 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6120697 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/6141199 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7853459 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7905004 enrich_references.chebi_xrefs
reaxys reaxys:2116510 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q965999 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Alclofenac enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
349ee615-9209-4d1c-8b1b-4895b496dfc3 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
8a36346b-c3a2-492e-a520-87ef5e93d63d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
d2a4cf17-e104-44bb-8fba-a29ff9114f96 Environmental → Air → Indoor EF 3.1 kg 0
3aa3239c-f3d4-46dd-bf4b-c7eb7d4d8692 Environmental → Air → Long-term EF 3.1 kg 0
20db3195-6fe3-435c-aaaa-8abf3e07bcd1 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
1a53deae-e9e9-457a-99a1-d29c81a249e6 Environmental → Air → Unknown EF 3.1 kg 0
473db730-5377-4393-b776-b48d01a6d50b Environmental → Ground → Agricultural EF 3.1 kg 0
1e7d8598-fd72-4a71-9566-26db6ffcaae5 Environmental → Ground → Non-agricultural EF 3.1 kg 0
16bba305-3c4e-4405-accb-dd37da0b83c8 Environmental → Ground → Unknown EF 3.1 kg 0
ef6c1dd8-debd-416e-9db7-b744457d5ad4 Environmental → Water → Long-term EF 3.1 kg 0
452794aa-9cd3-4c77-a154-7924181a5654 Environmental → Water → Ocean EF 3.1 kg 0
ac5c762f-d762-444f-ac50-39103f4485e6 Environmental → Water → Surface water EF 3.1 kg 0
d132da1f-0248-447f-b284-d45b1f959d5b Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-95aff18aa9e4c703",
  "prefLabel": [
    {
      "@value": "Alclofenac",
      "@language": "en",
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  ],
  "altLabel": [
    {
      "@value": "(4-Allyloxy-3-chlorphenyl)essigsaeure",
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      "@lang": "en",
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      }
    },
    {
      "@value": "2-(4-(Allyloxy)-3-chlorophenyl)acetic acid",
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    },
    {
      "@value": "2-(4-(Allyloxy)-3-chlorophenyl)aceticacid",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-[3-Chloro-4-(prop-2-en-1-yloxy)phenyl]acetic acid",
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      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "3-Chloro-4-(2-propen-1-yloxy)benzeneacetic acid",
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      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "3-Chloro-4-(2-propenyloxy)benzeneacetic acid",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "[3-Chloro-4-(allyloxy)phenyl]acetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "[3-chloro-4-(prop-2-en-1-yloxy)phenyl]acetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "[4-(allyloxy)-3-chlorophenyl]acetic acid",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_31183"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Acetic acid, [4-(allyloxy)-3-chlorophenyl]-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Aclofenac",
      "@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=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "alclofenaco",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "http://purl.obolibrary.org/obo/CHEBI_31183"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "alclofenacum",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_31183"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Alclophenac",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Allopydin",
      "@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=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzeneacetic acid, 3-chloro-4-(2-propen-1-yloxy)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzeneacetic acid, 3-chloro-4-(2-propenyloxy)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Epinal",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Medifenac",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mervan",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Neoston",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Prinalgin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Reufenac",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zumaril",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:22131-79-9",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=22131-79-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C11H11ClO3"
      ],
      "attested_by": {
        "C11H11ClO3": [
          "enrich_references.chebi_semantic",
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CCOc1ccc(CC(=O)O)cc1Cl"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "C=CCOc1ccc(CC(=O)O)cc1Cl"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
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          ]
        },
        {
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        }
      ],
      "attested_by": {
        "C=CCOc1ccc(CC(=O)O)cc1Cl": [
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C11H11ClO3/c1-2-5-15-10-4-3-8(6-9(10)12)7-11(13)14/h2-4,6H,1,5,7H2,(H,13,14)"
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      "provenance": [
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        },
        {
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          "prov:hadPrimarySource": [
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        }
      ],
      "attested_by": {
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      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
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