3-methylpyridine
Everything that changed this flow. Back to the flow
8068a373-11bc-4c5c-86ef-f4fce5114f82
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 18251' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3-methylpyridine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-99-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f5c48d2e9005a26b: {'108-99-6': '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, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, 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=['108-99-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39922']; candidate_pubchem_cids=[7970, 79081, 221520, 252732, 533936, 16639139]; selected_pubchem_cids=[7970]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 10,512 | bootstrap_labels | prefLabel | — | [{"@value":"3-methylpyridine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 10,513 | bootstrap_labels | name | 3-methylpyridine | — | Purged legacy name field to enforce prefLabel usage |
| 10,514 | bootstrap_labels | synonyms | [".beta.-Methylpyridine",".beta.-Picoline","3-Methyl pyridine","3-Picoline","3-Pyridylmethyl radical","AC1L1PZ0","AC1Q2… | [] | Removed legacy synonyms field in favor of structured labels |
| 126,120 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 126,121 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 216,827 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 237,193 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 237,194 | enrich_references | skos_definition | — | [{"@value":"A methylpyridine that is pyridine substituted by a methyl group at position 3.","@language":"en","provenanc… | Merged ChEBI/PubChem definitions into skos:definition |
| 237,195 | enrich_references | references | [] | [{"@id":"beilstein:1366","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"co… | Added references with provenance; cas_numbers=['108-99-6']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_39922']; candidate_pubchem_cids=[7970, 79081, 221520, 252732, 533936, 16639139]; selected_pubchem_cids=[7970]; 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 |
| 251,187 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | rdkit_pre_consensus from 'CC1=CN=CC=C1'; added: monoisotopic_mass |
| 255,872 | chebi_altlabels | altLabel | [] | [{"@value":"3-Mepy","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensu… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 262,150 | consensus_match | altLabel | [{"@value":"3-Mepy","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensu… | [{"@value":"3-Mepy","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensu… | group_key=3-methylpyridine||dimension=Environmental > media=Ground > geography=Agricultural; cas=108-99-6; added Common Chemistry CAS names as altLabel: NSC 18251, Pyridine, 3-methyl-, β-Methylpyridine, β-Picoline; object_uuid=fo-f5c48d2e9005a26b |
| 262,151 | consensus_match | cas_match_labels | — | {"108-99-6":"exactMatch"} | group_key=3-methylpyridine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-99-6': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f5c48d2e9005a26b: {'108-99-6': 'exactMatch'} |
| 276,372 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-methylpyridine' |
| 282,972 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | rdkit_post_consensus from 'Cc1cccnc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,447 | strip_catalogue_altlabels | altLabel | [{"@value":"3-Mepy","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensu… | [{"@value":"3-Mepy","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"consensu… | Removed 1 catalogue altLabel value(s): 'NSC 18251' (registry code) |
| 344,062 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8068a373-11bc-… | associations resolved on the elementary layer |
| 390,724 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H7N"],"a… | typed the way the ontology types it |
| 398,473 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260821T1554374006150000/10512 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v0 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v1 |
| ef:activity/change/20260821T1554374006150000/10513 | name | ef:agent/bootstrap_labels | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v1 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v2 |
| ef:activity/change/20260821T1554374006150000/10514 | synonyms | ef:agent/bootstrap_labels | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v2 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v3 |
| ef:activity/change/20260821T1554374006150000/126120 | context | ef:agent/default_context_mapping | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v3 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v4 |
| ef:activity/change/20260821T1554374006150000/126121 | context_iri | ef:agent/default_context_mapping | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v4 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v5 |
| ef:activity/change/20260821T1554374006150000/216827 | unit_iri | ef:agent/unit_normalization | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v5 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v6 |
| ef:activity/change/20260821T1554374006150000/237193 | properties | ef:agent/enrich_references | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v6 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v7 |
| ef:activity/change/20260821T1554374006150000/237194 | skos_definition | ef:agent/enrich_references | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v7 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v8 |
| ef:activity/change/20260821T1554374006150000/237195 | references | ef:agent/enrich_references | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v8 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v9 |
| ef:activity/change/20260821T1554374006150000/251187 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v9 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v10 |
| ef:activity/change/20260821T1554374006150000/255872 | altLabel | ef:agent/chebi_altlabels | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v10 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v11 |
| ef:activity/change/20260821T1554374006150000/262150 | altLabel | ef:agent/consensus_match | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v11 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v12 |
| ef:activity/change/20260821T1554374006150000/262151 | cas_match_labels | ef:agent/consensus_match | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v12 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v13 |
| ef:activity/change/20260821T1554374006150000/276372 | properties | ef:agent/opsin_iupac | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v13 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v14 |
| ef:activity/change/20260821T1554374006150000/282972 | properties | ef:agent/rdkit_post_consensus | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v14 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v15 |
| ef:activity/change/20260821T1554374006150000/289447 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v15 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v16 |
| ef:activity/change/20260821T1554374006150000/344062 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v16 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v17 |
| ef:activity/change/20260821T1554374006150000/390724 | properties | ef:agent/normalise_property_values | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v17 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v18 |
| ef:activity/change/20260821T1554374006150000/398473 | types | ef:agent/link_flows_to_their_substance | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v18 | ef:flow/8068a373-11bc-4c5c-86ef-f4fce5114f82/v19 |