2-ethylhexanoic Acid, Molybdenum Salt/n
Everything that changed this flow. Back to the flow
b12fb4aa-949c-4176-87e2-231d60212ead
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=2-ethylhexanoicacid,molybdenumsalt/n||dimension=Environmental > media=Water > water_body=Long-term; cas=34041-09-3; added Common Chemistry CAS names as altLabel: Hexanoic acid, 2-ethyl-, molybdenum salt, Hexanoic acid, 2-ethyl-, molybdenum salt (1:?); object_uuid=fo-9a1ecf83e3797476 |
| cas_match_labels | 1 | consensus_match | group_key=2-ethylhexanoicacid,molybdenumsalt/n||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'34041-09-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-9a1ecf83e3797476: {'34041-09-3': '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=['34041-09-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[118396, 169565, 19992637, 21585245, 73555739, 121233198]; selected_pubchem_cids=[73555739]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,546 | bootstrap_labels | prefLabel | — | [{"@value":"2-ethylhexanoic acid, molybdenum salt/n","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels… | Bootstrapped prefLabel from legacy name field |
| 2,547 | bootstrap_labels | name | 2-ethylhexanoic acid, molybdenum salt/n | — | Purged legacy name field to enforce prefLabel usage |
| 2,548 | bootstrap_labels | synonyms | ["organometallic","2-ethylhexanoicacid,molybdenumsalt","octmo150e","octmo155e"] | [] | Removed legacy synonyms field in favor of structured labels |
| 155,224 | 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 |
| 155,225 | 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 |
| 214,188 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,674 | normalize_name_case | prefLabel | [{"@value":"2-ethylhexanoic acid, molybdenum salt/n","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels… | [{"@value":"2-ethylhexanoic Acid, Molybdenum Salt/n","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,627 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,628 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,629 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.047.082","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['34041-09-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[118396, 169565, 19992637, 21585245, 73555739, 121233198]; selected_pubchem_cids=[73555739]; 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 |
| 249,022 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | rdkit_pre_consensus from 'CCCCC(CC)C(=O)O.[Mo]'; added: molecular_mass, monoisotopic_mass |
| 260,808 | consensus_match | altLabel | [] | [{"@value":"Hexanoic acid, 2-ethyl-, molybdenum salt","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match… | group_key=2-ethylhexanoicacid,molybdenumsalt/n||dimension=Environmental > media=Water > water_body=Long-term; cas=34041-09-3; added Common Chemistry CAS names as altLabel: Hexanoic acid, 2-ethyl-, molybdenum salt, Hexanoic acid, 2-ethyl-, molybdenum salt (1:?); object_uuid=fo-9a1ecf83e3797476 |
| 260,809 | consensus_match | cas_match_labels | — | {"34041-09-3":"exactMatch"} | group_key=2-ethylhexanoicacid,molybdenumsalt/n||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'34041-09-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-9a1ecf83e3797476: {'34041-09-3': 'exactMatch'} |
| 280,561 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | rdkit_post_consensus from 'CCCCC(CC)C(=O)O.[Mo]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 358,636 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b12fb4aa-949c-… | associations resolved on the elementary layer |
| 388,434 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H16MoO2"… | typed the way the ontology types it |
| 395,168 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260821T1302361922970000/2546 | prefLabel | ef:agent/bootstrap_labels | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v0 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v1 |
| ef:activity/change/20260821T1302361922970000/2547 | name | ef:agent/bootstrap_labels | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v1 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v2 |
| ef:activity/change/20260821T1302361922970000/2548 | synonyms | ef:agent/bootstrap_labels | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v2 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v3 |
| ef:activity/change/20260821T1302361922970000/155224 | context | ef:agent/default_context_mapping | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v3 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v4 |
| ef:activity/change/20260821T1302361922970000/155225 | context_iri | ef:agent/default_context_mapping | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v4 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v5 |
| ef:activity/change/20260821T1302361922970000/214188 | unit_iri | ef:agent/unit_normalization | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v5 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v6 |
| ef:activity/change/20260821T1302361922970000/221674 | prefLabel | ef:agent/normalize_name_case | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v6 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v7 |
| ef:activity/change/20260821T1302361922970000/229627 | properties | ef:agent/enrich_references | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v7 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v8 |
| ef:activity/change/20260821T1302361922970000/229628 | skos_definition | ef:agent/enrich_references | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v8 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v9 |
| ef:activity/change/20260821T1302361922970000/229629 | references | ef:agent/enrich_references | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v9 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v10 |
| ef:activity/change/20260821T1302361922970000/249022 | properties | ef:agent/rdkit_pre_consensus | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v10 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v11 |
| ef:activity/change/20260821T1302361922970000/260808 | altLabel | ef:agent/consensus_match | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v11 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v12 |
| ef:activity/change/20260821T1302361922970000/260809 | cas_match_labels | ef:agent/consensus_match | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v12 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v13 |
| ef:activity/change/20260821T1302361922970000/280561 | properties | ef:agent/rdkit_post_consensus | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v13 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v14 |
| ef:activity/change/20260821T1302361922970000/358636 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v14 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v15 |
| ef:activity/change/20260821T1302361922970000/388434 | properties | ef:agent/normalise_property_values | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v15 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v16 |
| ef:activity/change/20260821T1302361922970000/395168 | types | ef:agent/link_flows_to_their_substance | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v16 | ef:flow/b12fb4aa-949c-4176-87e2-231d60212ead/v17 |