Consensus flow list

Identity

Type
AtomCation
CAS
22541-55-5
EC
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Selenium(4+)

Alternative labels

1

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 4
Has element chemrof:has_element {'@id': 'https://vocab.brightway.dev/flow-objects/fo-476008ff1af94efb'}
InChI2D key string chemrof:inchi2d_key_string VKDXOLSWFYDUNP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/Se/q+4
IUPAC name chemrof:IUPAC_name Selenium (iv)
Molecular formula chemrof:molecular_formula Se+4
Molecular mass chemrof:molecular_mass 78.96
Monoisotopic mass chemrof:monoisotopic_mass 79.914327
Relationships relationships {"parent_element_flow_object_id":"fo-476008ff1af94efb","relationship_type":"ion_of","provenance":{"prov:wasGeneratedBy":"flow_layers.pubchem_element_enrichment","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["EF 3.1","PubChem","Common Chemistry"],"prov:wasDerivedFrom":"ion_label_to_base_element_mapping"}}
SMILES string chemrof:smiles_string [Se+4]

Known URLs

6

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=22541-55-5 enrich_references.consensus_cas_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:190426 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID301355427 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68283 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/104791 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27077643 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
977f8235-3611-4be7-b761-1b95baa801df Environmental → Air → Aircraft cruise height EF 3.1 kg 2
c524ef99-d8a8-481c-a24a-3478aa21414d Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
891e1674-a9ba-4501-8e75-f1b55f246368 Environmental → Air → Indoor EF 3.1 kg 2
55f0b029-c36d-4c70-8044-65059b762e9a Environmental → Air → Long-term EF 3.1 kg 0
a331bf24-4568-411b-a111-dbf356b735e0 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
d734e649-6a4b-47a7-9302-fe541728e7ac Environmental → Air → Unknown EF 3.1 kg 2
d4faae1a-0fa7-48e8-b596-b6567cf14968 Environmental → Ground → Agricultural EF 3.1 kg 2
bda3d84c-00e7-4521-9959-f8f9e1173eef Environmental → Ground → Non-agricultural EF 3.1 kg 2
79d7daeb-f76c-4e34-b150-7fcd913d6e1a Environmental → Ground → Unknown EF 3.1 kg 2
5a0ffcbc-f652-494e-b364-20ce81707a1d Environmental → Water → Long-term EF 3.1 kg 0
4247bc0a-bdcd-4b40-b33a-31565e5ab026 Environmental → Water → Ocean EF 3.1 kg 2
3c0b68ca-2c1d-417e-a5b2-3f502ef3fa1a Environmental → Water → Surface water EF 3.1 kg 2
244df941-a16b-4d8e-84f3-aafe77ca9713 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-2a80cc2293a9893d",
  "prefLabel": [
    {
      "@value": "Selenium(4+)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "flow_layers.pubchem_element_enrichment",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Common Chemistry",
          "EF 3.1",
          "PubChem"
        ],
        "prov:wasDerivedFrom": "ion.prefLabel.titlecase"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "selenium (iv)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "carry_member_names",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "source_flow_name"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "Se+4"
      ],
      "attested_by": {
        "Se+4": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:104791"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "VKDXOLSWFYDUNP-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "VKDXOLSWFYDUNP-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:104791"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "[Se+4]"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Selenium (iv)"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ],
      "attested_by": {
        "[Se+4]": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/Se/q+4"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Selenium (iv)"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/Se/q+4": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Selenium (iv)"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Selenium (iv)"
        ]
      },
      "attested_by": {
        "Selenium (iv)": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        78.96
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ],
      "attested_by": {
        "78.96": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
        79.914327
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[Se+4]"
          ]
        }
      ],
      "attested_by": {
        "79.914327": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "relationships": {
      "parent_element_flow_object_id": "fo-476008ff1af94efb",
      "relationship_type": "ion_of",
      "provenance": {
        "prov:wasGeneratedBy": "flow_layers.pubchem_element_enrichment",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "PubChem",
          "Common Chemistry"
        ],
        "prov:wasDerivedFrom": "ion_label_to_base_element_mapping"
      }
    },
    "https://w3id.org/chemrof/elemental_charge": {
      "rdfs:label": "elemental charge",
      "@value": [
        4
      ],
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/NUM",
      "provenance": {
        "prov:wasGeneratedBy": "flow_layers.pubchem_element_enrichment",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ion_label_charge_state_regex_parse"
      }
    },
    "https://w3id.org/chemrof/has_element": {
      "rdfs:label": "has element",
      "@value": [
        {
          "@id": "https://vocab.brightway.dev/flow-objects/fo-476008ff1af94efb"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "relationships.parent_element_flow_object_id"
      }
    }
  },
  "references": [
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=22541-55-5",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "22541-55-5"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID301355427",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[22541-55-5]"
      }
    },
    {
      "@id": "https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68283",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[22541-55-5]"
      }
    },
    {
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      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:104791;CAS:22541-55-5"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[22541-55-5]"
      }
    },
    {
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      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:104791;CAS:22541-55-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[22541-55-5]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27077643",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:104791;CAS:22541-55-5"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[22541-55-5]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "244df941-a16b-4d8e-84f3-aafe77ca9713",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "monoatomic_ion",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/AtomCation"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.monoatomic_ion"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "22541-55-5"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=22541-55-5"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "flow_layers.pubchem_element_enrichment",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1;PubChem;Common Chemistry;EC inventory"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/AtomCation"
  ]
}

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