Copper(i) Sulphide
Everything that changed this flow. Back to the flow
b4994b80-7260-437a-afcd-bd1fab5b8099
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=copper(i)sulphide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory']; cas_sources={'22205-45-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-29fc1b3604865f13: {'22205-45-4': '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 air, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['22205-45-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_51114']; candidate_pubchem_cids=[62755, 10130093, 25199590, 101611501]; selected_pubchem_cids=[10130093]; 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 |
|---|---|---|---|---|---|
| 6,690 | bootstrap_labels | prefLabel | — | [{"@value":"copper(i) sulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 6,691 | bootstrap_labels | name | copper(i) sulphide | — | Purged legacy name field to enforce prefLabel usage |
| 6,692 | bootstrap_labels | synonyms | ["inorganic","dicoppersulphide"] | [] | Removed legacy synonyms field in favor of structured labels |
| 157,062 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 157,063 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 215,573 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,629 | normalize_name_case | prefLabel | [{"@value":"copper(i) sulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"Copper(i) Sulphide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,600 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 233,601 | enrich_references | skos_definition | — | [{"@value":"A copper sulfide in which the metal is in the +1 oxidation state.","@language":"en","provenance":{"prov:was… | Merged ChEBI/PubChem definitions into skos:definition |
| 233,602 | enrich_references | references | [] | [{"@id":"gmelin:9318","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"conse… | Added references with provenance; cas_numbers=['22205-45-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_51114']; candidate_pubchem_cids=[62755, 10130093, 25199590, 101611501]; selected_pubchem_cids=[10130093]; 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 |
| 250,168 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | rdkit_pre_consensus from '[Cu+].[Cu+].[S-2]'; added: monoisotopic_mass |
| 255,203 | chebi_altlabels | altLabel | [] | [{"@value":"Kupfer(I)-sulfid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo"… | Added 8 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 265,311 | consensus_match | altLabel | [{"@value":"Kupfer(I)-sulfid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo"… | [{"@value":"Kupfer(I)-sulfid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo"… | group_key=copper(i)sulphide||dimension=Environmental > media=Water > water_body=Long-term; cas=22205-45-4; added Common Chemistry CAS names as altLabel: Austro Tecc CB 500, Copper sulfide (Cu<sub>0.67</sub>S<sub>0.33</sub>), Copper sulfide (Cu<sub>2</sub>S), Cuprous sulfide (Cu<sub>2</sub>S); object_uuid=fo-29fc1b3604865f13 |
| 265,312 | consensus_match | cas_match_labels | — | {"22205-45-4":"exactMatch"} | group_key=copper(i)sulphide||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory']; cas_sources={'22205-45-4': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-29fc1b3604865f13: {'22205-45-4': 'exactMatch'} |
| 275,302 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Copper(i) Sulphide' |
| 281,812 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | rdkit_post_consensus from '[S]=[Cu-]'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,866 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 292,325 | dedupe_altlabels | altLabel | [{"@value":"Kupfer(I)-sulfid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo"… | [{"@value":"Kupfer(I)-sulfid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo"… | Deduplicated altLabel values and removed entries matching prefLabel |
| 359,556 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b4994b80-7260-… | associations resolved on the elementary layer |
| 389,606 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["2Cu.S","Cu… | typed the way the ontology types it |
| 396,833 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260822T0600486828500000/6690 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v0 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v1 |
| ef:activity/change/20260822T0600486828500000/6691 | name | ef:agent/bootstrap_labels | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v1 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v2 |
| ef:activity/change/20260822T0600486828500000/6692 | synonyms | ef:agent/bootstrap_labels | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v2 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v3 |
| ef:activity/change/20260822T0600486828500000/157062 | context | ef:agent/default_context_mapping | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v3 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v4 |
| ef:activity/change/20260822T0600486828500000/157063 | context_iri | ef:agent/default_context_mapping | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v4 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v5 |
| ef:activity/change/20260822T0600486828500000/215573 | unit_iri | ef:agent/unit_normalization | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v5 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v6 |
| ef:activity/change/20260822T0600486828500000/222629 | prefLabel | ef:agent/normalize_name_case | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v6 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v7 |
| ef:activity/change/20260822T0600486828500000/233600 | properties | ef:agent/enrich_references | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v7 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v8 |
| ef:activity/change/20260822T0600486828500000/233601 | skos_definition | ef:agent/enrich_references | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v8 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v9 |
| ef:activity/change/20260822T0600486828500000/233602 | references | ef:agent/enrich_references | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v9 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v10 |
| ef:activity/change/20260822T0600486828500000/250168 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v10 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v11 |
| ef:activity/change/20260822T0600486828500000/255203 | altLabel | ef:agent/chebi_altlabels | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v11 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v12 |
| ef:activity/change/20260822T0600486828500000/265311 | altLabel | ef:agent/consensus_match | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v12 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v13 |
| ef:activity/change/20260822T0600486828500000/265312 | cas_match_labels | ef:agent/consensus_match | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v13 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v14 |
| ef:activity/change/20260822T0600486828500000/275302 | properties | ef:agent/opsin_iupac | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v14 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v15 |
| ef:activity/change/20260822T0600486828500000/281812 | properties | ef:agent/rdkit_post_consensus | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v15 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v16 |
| ef:activity/change/20260822T0600486828500000/286866 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v16 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v17 |
| ef:activity/change/20260822T0600486828500000/292325 | altLabel | ef:agent/dedupe_altlabels | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v17 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v18 |
| ef:activity/change/20260822T0600486828500000/359556 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v18 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v19 |
| ef:activity/change/20260822T0600486828500000/389606 | properties | ef:agent/normalise_property_values | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v19 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v20 |
| ef:activity/change/20260822T0600486828500000/396833 | types | ef:agent/link_flows_to_their_substance | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v20 | ef:flow/b4994b80-7260-437a-afcd-bd1fab5b8099/v21 |