Consensus flow list

Identity

Type
AtomCation
CAS
17428-41-0
EC
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Arsenic(5+)

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 5
Has element chemrof:has_element {'@id': 'https://vocab.brightway.dev/flow-objects/fo-59b3f7e57542f6bb'}
InChI2D key string chemrof:inchi2d_key_string HAYXDMNJJFVXCI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/As/q+5
IUPAC name chemrof:IUPAC_name Arsenic (v)
Molecular formula chemrof:molecular_formula As+5
Molecular mass chemrof:molecular_mass 74.922
Monoisotopic mass chemrof:monoisotopic_mass 74.918854
Relationships relationships {"parent_element_flow_object_id":"fo-59b3f7e57542f6bb","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 [As+5]

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=17428-41-0 enrich_references.consensus_cas_link
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:35829 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID70872433 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68236 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/104737 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q26840818 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
87c52b66-df1e-4030-b510-3577553b5025 Environmental → Air → Aircraft cruise height EF 3.1 kg 6
e8038e52-daaf-4342-9a97-ece4d0c5f5c2 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 6
e14228d3-9152-48be-af9f-7b6068e793ad Environmental → Air → Indoor EF 3.1 kg 6
cb668251-230f-49af-adc5-206ccb448f68 Environmental → Air → Long-term EF 3.1 kg 0
fb8f99c3-d0aa-48a0-b612-4d075f020b53 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 6
fd35609e-968a-4dcf-8172-c621ff680ad7 Environmental → Air → Unknown EF 3.1 kg 6
e131f56e-cf2d-4ea7-bf88-1bb2025f63de Environmental → Ground → Agricultural EF 3.1 kg 6
92e949b7-5a15-41bf-ba2f-f376f76850bc Environmental → Ground → Non-agricultural EF 3.1 kg 6
0b6a6e13-8a7c-4724-b775-653745f8d113 Environmental → Ground → Unknown EF 3.1 kg 6
acbb825a-e734-4e9d-b86b-163b01be5d0d Environmental → Water → Long-term EF 3.1 kg 0
a777d0d0-0966-4441-addd-ac55b26724ff Environmental → Water → Ocean EF 3.1 kg 6
90769896-db48-419a-a28d-ae54b0b381ee Environmental → Water → Surface water EF 3.1 kg 6
38d3176c2d266b24a00c2c39535a1c79d4af102e Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
16255aec-0f20-4b9f-9fee-b5ab1255e003 Environmental → Water → Unknown EF 3.1 kg 6

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-150478f522686ef2",
  "prefLabel": [
    {
      "@value": "Arsenic(5+)",
      "@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": [],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "As+5"
      ],
      "attested_by": {
        "As+5": [
          "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:104737"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[As+5]"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "HAYXDMNJJFVXCI-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "HAYXDMNJJFVXCI-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": [
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          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "[As+5]"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
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          "prov:hadPrimarySource": [
            "Arsenic (v)"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[As+5]"
          ]
        }
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/As/q+5"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
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          ]
        },
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "InChI=1S/As/q+5": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Arsenic (v)"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Arsenic (v)"
        ]
      },
      "attested_by": {
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          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
        74.922
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "74.922": [
          "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": [
        74.918854
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[As+5]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "[As+5]"
          ]
        }
      ],
      "attested_by": {
        "74.918854": [
          "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-59b3f7e57542f6bb",
      "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": [
        5
      ],
      "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": [
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        ],
        "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-59b3f7e57542f6bb"
        }
      ],
      "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=17428-41-0",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "17428-41-0"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID70872433",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[17428-41-0]"
      }
    },
    {
      "@id": "https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C68236",
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[17428-41-0]"
      }
    },
    {
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[17428-41-0]"
      }
    },
    {
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      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[17428-41-0]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q26840818",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:104737;CAS:17428-41-0"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[17428-41-0]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "0b6a6e13-8a7c-4724-b775-653745f8d113",
    "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": [
        "17428-41-0"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=17428-41-0"
      ],
      "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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