4-tert-butylpyridine
Everything that changed this flow. Back to the flow
19bf66a1-cd45-4f5e-8fd5-415ebf7c1634
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 5104' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=4-tert-butylpyridine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3978-81-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4c3e06c2654a6f2: {'3978-81-2': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['3978-81-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[19878]; selected_pubchem_cids=[19878]; 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 |
|---|---|---|---|---|---|
| 16,364 | bootstrap_labels | prefLabel | — | [{"@value":"4-tert-butylpyridine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribut… | Bootstrapped prefLabel from legacy name field |
| 16,365 | bootstrap_labels | name | 4-tert-butylpyridine | — | Purged legacy name field to enforce prefLabel usage |
| 16,366 | bootstrap_labels | synonyms | ["AC1L2F2B","AKOS000120207","B0388","FT-0082211","I02-2635","Pyridine, 4-(1,1-dimethylethyl)-","Pyridine, 4-tert-butyl-… | [] | Removed legacy synonyms field in favor of structured labels |
| 53,566 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 53,567 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 218,711 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 242,570 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 242,571 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,572 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J124.330F","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['3978-81-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[19878]; selected_pubchem_cids=[19878]; 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 |
| 252,755 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | rdkit_pre_consensus from 'CC(C)(C)C1=CC=NC=C1'; added: molecular_mass, monoisotopic_mass |
| 262,948 | consensus_match | altLabel | [] | [{"@value":"4-(1,1-Dimethylethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=4-tert-butylpyridine||dimension=Environmental > media=Water > water_body=Long-term; cas=3978-81-2; added Common Chemistry CAS names as altLabel: 4-(1,1-Dimethylethyl)pyridine, 4-<em>t</em>-Butylpyridine, <em>p</em>-<em>tert</em>-Butylpyridine, NSC 5104, Pyridine, 4-(1,1-dimethylethyl)-, Pyridine, 4-<em>tert</em>-butyl-; object_uuid=fo-e4c3e06c2654a6f2 |
| 262,949 | consensus_match | cas_match_labels | — | {"3978-81-2":"exactMatch"} | group_key=4-tert-butylpyridine||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'3978-81-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e4c3e06c2654a6f2: {'3978-81-2': 'exactMatch'} |
| 277,960 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-tert-butylpyridine' |
| 284,679 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | rdkit_post_consensus from 'CC(C)(C)c1ccncc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,572 | strip_catalogue_altlabels | altLabel | [{"@value":"4-(1,1-Dimethylethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"4-(1,1-Dimethylethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Removed 1 catalogue altLabel value(s): 'NSC 5104' (registry code) |
| 307,810 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/19bf66a1-cd45-… | associations resolved on the elementary layer |
| 392,310 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | typed the way the ontology types it |
| 400,719 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1554374006150000/16364 | prefLabel | ef:agent/bootstrap_labels | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v0 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v1 |
| ef:activity/change/20260821T1554374006150000/16365 | name | ef:agent/bootstrap_labels | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v1 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v2 |
| ef:activity/change/20260821T1554374006150000/16366 | synonyms | ef:agent/bootstrap_labels | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v2 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v3 |
| ef:activity/change/20260821T1554374006150000/53566 | context | ef:agent/default_context_mapping | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v3 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v4 |
| ef:activity/change/20260821T1554374006150000/53567 | context_iri | ef:agent/default_context_mapping | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v4 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v5 |
| ef:activity/change/20260821T1554374006150000/218711 | unit_iri | ef:agent/unit_normalization | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v5 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v6 |
| ef:activity/change/20260821T1554374006150000/242570 | properties | ef:agent/enrich_references | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v6 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v7 |
| ef:activity/change/20260821T1554374006150000/242571 | skos_definition | ef:agent/enrich_references | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v7 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v8 |
| ef:activity/change/20260821T1554374006150000/242572 | references | ef:agent/enrich_references | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v8 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v9 |
| ef:activity/change/20260821T1554374006150000/252755 | properties | ef:agent/rdkit_pre_consensus | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v9 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v10 |
| ef:activity/change/20260821T1554374006150000/262948 | altLabel | ef:agent/consensus_match | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v10 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v11 |
| ef:activity/change/20260821T1554374006150000/262949 | cas_match_labels | ef:agent/consensus_match | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v11 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v12 |
| ef:activity/change/20260821T1554374006150000/277960 | properties | ef:agent/opsin_iupac | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v12 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v13 |
| ef:activity/change/20260821T1554374006150000/284679 | properties | ef:agent/rdkit_post_consensus | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v13 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v14 |
| ef:activity/change/20260821T1554374006150000/290572 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v14 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v15 |
| ef:activity/change/20260821T1554374006150000/307810 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v15 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v16 |
| ef:activity/change/20260821T1554374006150000/392310 | properties | ef:agent/normalise_property_values | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v16 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v17 |
| ef:activity/change/20260821T1554374006150000/400719 | types | ef:agent/link_flows_to_their_substance | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v17 | ef:flow/19bf66a1-cd45-4f5e-8fd5-415ebf7c1634/v18 |