Ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, Ammonium (1:2), (pb-7-11'-121'3'3)
Everything that changed this flow. Back to the flow
5faf7405-fc7e-4d49-819e-8f812afee555
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | 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=ferrate(2-),[[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-,ammonium(1:2),(pb-7-11'-121'3'3)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory']; cas_sources={'68413-60-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-c1fc96fabd9af414: {'68413-60-5': '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 water > Emissions to sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['68413-60-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[105729, 110217, 49791625, 73556453, 139594169]; selected_pubchem_cids=[139594169]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 6,440 | bootstrap_labels | prefLabel | — | [{"@value":"ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, ammonium (1:2),… | Bootstrapped prefLabel from legacy name field |
| 6,441 | bootstrap_labels | name | ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, ammonium (1:2), (pb-7-11'-1… | — | Purged legacy name field to enforce prefLabel usage |
| 6,442 | bootstrap_labels | synonyms | ["organic","diammonium[[n,n'","-ethylenebis[n-(carboxymethyl)glycinato]](4-)-n,n'",",o,o'",",on,on'","]… | [] | Removed legacy synonyms field in favor of structured labels |
| 106,598 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 106,599 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 215,490 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,572 | normalize_name_case | prefLabel | [{"@value":"ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, ammonium (1:2),… | [{"@value":"Ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, Ammonium (1:2),… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,368 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 233,369 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,370 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.063.828","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['68413-60-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[105729, 110217, 49791625, 73556453, 139594169]; selected_pubchem_cids=[139594169]; 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 |
| 250,100 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | rdkit_pre_consensus from 'C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[NH4+].[NH4+].[OH-].[Fe+3]'; added: molecular_mass, monoisotopic_mass |
| 267,150 | consensus_match | altLabel | [] | [{"@value":"Ferrate(2-), [[<em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-(carboxymethyl)glycinato]](4-)-<em>N</em… | group_key=ferrate(2-),[[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-,ammonium(1:2),(pb-7-11'-121'3'3)||dimension=Environmental > media=Air > strata=Long-term; cas=68413-60-5; added Common Chemistry CAS names as altLabel: Ferrate(2-), [[<em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-(carboxymethyl)glycinato]](4-)-<em>N</em>,<em>N</em>′,<em>O</em>,<em>O</em>′,<em>O</em><sup>N</sup>,<em>O</em><sup>N′</sup>]hydroxy-, diammonium, (<em>PB</em>-7-11′-121′3′3)-, Ferrate(2-), [[<em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-[(carboxy-κ<em>O</em>)methyl]glycinato-κ<em>N</em>,κ<em>O</em>]](4-)]hydroxy-, ammonium (1:2), (<em>PB</em>-7-11′-121′3′3)-, Ferrate(2-), [[<em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-[(carboxy-κ<em>O</em>)methyl]glycinato-κ<em>N</em>,κ<em>O</em>]](4-)]hydroxy-, diammonium, (<em>PB</em>-7-11′-121′3′3)-; object_uuid=fo-c1fc96fabd9af414 |
| 267,151 | consensus_match | cas_match_labels | — | {"68413-60-5":"exactMatch"} | group_key=ferrate(2-),[[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-,ammonium(1:2),(pb-7-11'-121'3'3)||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory']; cas_sources={'68413-60-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-c1fc96fabd9af414: {'68413-60-5': 'exactMatch'} |
| 281,740 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | rdkit_post_consensus from 'C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[NH4+].[NH4+].[OH-].[Fe+3]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,316 | dedupe_altlabels | altLabel | [{"@value":"Ferrate(2-), [[<em>N</em>,<em>N</em>′-1,2-ethanediylbis[<em>N</em>-(carboxymethyl)glycinato]](4-)-<em>N</em… | [{"@value":"Ferrate(2-), [[N,N′-1,2-ethanediylbis[N-(carboxymethyl)glycinato]](4-)-N,N′,O,O′,ON,ON′]hydroxy-, diammoniu… | Deduplicated altLabel values and removed entries matching prefLabel |
| 334,297 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5faf7405-fc7e-… | associations resolved on the elementary layer |
| 389,540 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H21FeN4… | typed the way the ontology types it |
| 396,736 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260822T0600486828500000/6440 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v0 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v1 |
| ef:activity/change/20260822T0600486828500000/6441 | name | ef:agent/bootstrap_labels | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v1 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v2 |
| ef:activity/change/20260822T0600486828500000/6442 | synonyms | ef:agent/bootstrap_labels | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v2 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v3 |
| ef:activity/change/20260822T0600486828500000/106598 | context | ef:agent/default_context_mapping | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v3 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v4 |
| ef:activity/change/20260822T0600486828500000/106599 | context_iri | ef:agent/default_context_mapping | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v4 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v5 |
| ef:activity/change/20260822T0600486828500000/215490 | unit_iri | ef:agent/unit_normalization | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v5 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v6 |
| ef:activity/change/20260822T0600486828500000/222572 | prefLabel | ef:agent/normalize_name_case | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v6 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v7 |
| ef:activity/change/20260822T0600486828500000/233368 | properties | ef:agent/enrich_references | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v7 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v8 |
| ef:activity/change/20260822T0600486828500000/233369 | skos_definition | ef:agent/enrich_references | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v8 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v9 |
| ef:activity/change/20260822T0600486828500000/233370 | references | ef:agent/enrich_references | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v9 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v10 |
| ef:activity/change/20260822T0600486828500000/250100 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v10 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v11 |
| ef:activity/change/20260822T0600486828500000/267150 | altLabel | ef:agent/consensus_match | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v11 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v12 |
| ef:activity/change/20260822T0600486828500000/267151 | cas_match_labels | ef:agent/consensus_match | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v12 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v13 |
| ef:activity/change/20260822T0600486828500000/281740 | properties | ef:agent/rdkit_post_consensus | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v13 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v14 |
| ef:activity/change/20260822T0600486828500000/292316 | altLabel | ef:agent/dedupe_altlabels | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v14 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v15 |
| ef:activity/change/20260822T0600486828500000/334297 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v15 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v16 |
| ef:activity/change/20260822T0600486828500000/389540 | properties | ef:agent/normalise_property_values | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v16 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v17 |
| ef:activity/change/20260822T0600486828500000/396736 | types | ef:agent/link_flows_to_their_substance | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v17 | ef:flow/5faf7405-fc7e-4d49-819e-8f812afee555/v18 |