Thiocyanate
Everything that changed this flow. Back to the flow
fd0a1870-1cb2-451f-a889-f88c4df60000
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| altLabel | 4 | chebi_altlabels, consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| prefLabel | 3 | bootstrap_labels, consensus_match, normalize_name_case | cas=302-04-5; cc_chebi_agreed_name='Thiocyanate'; object_uuid=fo-ba3efa2129c912bc |
| cas_match_labels | 1 | consensus_match | group_key=thiocyanicacid(-1ion)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi']; cas_sources={'302-04-5': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-ba3efa2129c912bc: {'302-04-5': 'exactMatch'} |
| concept_associations | 1 | carry_associations_onto_flows | associations resolved on the elementary layer |
| context | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['302-04-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_18022']; candidate_pubchem_cids=[9322]; selected_pubchem_cids=[9322]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| skos_definition | 1 | enrich_references | Merged ChEBI/PubChem definitions into skos:definition |
| synonyms | 1 | bootstrap_labels | Removed legacy synonyms field in favor of structured labels |
| types | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| unit_iri | 1 | unit_normalization | Unit IRI set from normalization of 'kg' |
Where several steps wrote one field, the last one won — and the log below shows the sequence.
Changes
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 13,823 | bootstrap_labels | prefLabel | — | [{"@value":"thiocyanic acid (-1 ion)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 13,824 | bootstrap_labels | name | thiocyanic acid (-1 ion) | — | Purged legacy name field to enforce prefLabel usage |
| 13,825 | bootstrap_labels | synonyms | ["AC1L1ST7","HSCN","Isothiocyanate","N#C-S(-)","NCS-","Rhodanid","Rhodanide","SCN(-)","Thiocyanate anion","Thiocyanate… | [] | Removed legacy synonyms field in favor of structured labels |
| 201,758 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 201,759 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 217,906 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,296 | normalize_name_case | prefLabel | [{"@value":"thiocyanic acid (-1 ion)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Thiocyanic Acid (-1 Ion)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 240,274 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 240,275 | enrich_references | skos_definition | — | [{"@value":"A pseudohalide anion obtained by deprotonation of the thiol group of thiocyanic acid.","@language":"en","pr… | Merged ChEBI/PubChem definitions into skos:definition |
| 240,276 | enrich_references | references | [] | [{"@id":"beilstein:1901207","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['302-04-5']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_18022']; candidate_pubchem_cids=[9322]; selected_pubchem_cids=[9322]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| 252,085 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | rdkit_pre_consensus from 'C(#N)[S-]'; added: monoisotopic_mass |
| 256,253 | chebi_altlabels | altLabel | [] | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | Added 13 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,574 | consensus_match | prefLabel | [{"@value":"Thiocyanic Acid (-1 Ion)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Thiocyanate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"con… | cas=302-04-5; cc_chebi_agreed_name='Thiocyanate'; object_uuid=fo-ba3efa2129c912bc |
| 272,575 | consensus_match | altLabel | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | cas=302-04-5; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-ba3efa2129c912bc |
| 272,576 | consensus_match | altLabel | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | group_key=thiocyanicacid(-1ion)||dimension=Environmental > media=Air > strata=Long-term; cas=302-04-5; added Common Chemistry CAS names as altLabel: Isothiocyanic acid, ion(1-), Thiocyanate (NCS<sup>1-</sup>), Thiocyanate anion, Thiocyanic acid, ion(1-), Thiocyanide; object_uuid=fo-ba3efa2129c912bc |
| 272,577 | consensus_match | cas_match_labels | — | {"302-04-5":"exactMatch"} | group_key=thiocyanicacid(-1ion)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['chebi']; cas_sources={'302-04-5': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-ba3efa2129c912bc: {'302-04-5': 'exactMatch'} |
| 283,951 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | rdkit_post_consensus from 'C(#N)[S-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,714 | dedupe_altlabels | altLabel | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | [{"@value":"N#C-S(-)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consen… | Deduplicated altLabel values and removed entries matching prefLabel |
| 381,913 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fd0a1870-1cb2-… | associations resolved on the elementary layer |
| 391,632 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CNS","CNS-… | typed the way the ontology types it |
| 399,754 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularAnion"] | the substance's answer, copied onto its flow |
PROV-O trail
21 activitiesOne activity per change: which version of the flow it consumed, and which it produced. The values are on the change with the same number — stored once, not twice.
| Activity | Field | Agent | Used | Generated |
|---|---|---|---|---|
| ef:activity/change/20260821T1302361922970000/13823 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v0 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v1 |
| ef:activity/change/20260821T1302361922970000/13824 | name | ef:agent/bootstrap_labels | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v1 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v2 |
| ef:activity/change/20260821T1302361922970000/13825 | synonyms | ef:agent/bootstrap_labels | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v2 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v3 |
| ef:activity/change/20260821T1302361922970000/201758 | context | ef:agent/default_context_mapping | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v3 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v4 |
| ef:activity/change/20260821T1302361922970000/201759 | context_iri | ef:agent/default_context_mapping | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v4 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v5 |
| ef:activity/change/20260821T1302361922970000/217906 | unit_iri | ef:agent/unit_normalization | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v5 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v6 |
| ef:activity/change/20260821T1302361922970000/224296 | prefLabel | ef:agent/normalize_name_case | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v6 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v7 |
| ef:activity/change/20260821T1302361922970000/240274 | properties | ef:agent/enrich_references | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v7 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v8 |
| ef:activity/change/20260821T1302361922970000/240275 | skos_definition | ef:agent/enrich_references | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v8 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v9 |
| ef:activity/change/20260821T1302361922970000/240276 | references | ef:agent/enrich_references | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v9 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v10 |
| ef:activity/change/20260821T1302361922970000/252085 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v10 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v11 |
| ef:activity/change/20260821T1302361922970000/256253 | altLabel | ef:agent/chebi_altlabels | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v11 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v12 |
| ef:activity/change/20260821T1302361922970000/272574 | prefLabel | ef:agent/consensus_match | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v12 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v13 |
| ef:activity/change/20260821T1302361922970000/272575 | altLabel | ef:agent/consensus_match | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v13 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v14 |
| ef:activity/change/20260821T1302361922970000/272576 | altLabel | ef:agent/consensus_match | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v14 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v15 |
| ef:activity/change/20260821T1302361922970000/272577 | cas_match_labels | ef:agent/consensus_match | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v15 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v16 |
| ef:activity/change/20260821T1302361922970000/283951 | properties | ef:agent/rdkit_post_consensus | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v16 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v17 |
| ef:activity/change/20260821T1302361922970000/292714 | altLabel | ef:agent/dedupe_altlabels | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v17 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v18 |
| ef:activity/change/20260821T1302361922970000/381913 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v18 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v19 |
| ef:activity/change/20260821T1302361922970000/391632 | properties | ef:agent/normalise_property_values | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v19 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v20 |
| ef:activity/change/20260821T1302361922970000/399754 | types | ef:agent/link_flows_to_their_substance | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v20 | ef:flow/fd0a1870-1cb2-451f-a889-f88c4df60000/v21 |