2,4,5-Trimethylaniline
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-9d3f-0050c2490048
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 | consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 37004' (registry code), 'NSC 5297' (registry code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=137-17-7; cc_chebi_agreed_name='2,4,5-Trimethylaniline'; object_uuid=fo-a0b4809c155aca60 |
| cas_match_labels | 1 | consensus_match | group_key=2,4,5-trimethylbenzenamine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'137-17-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a0b4809c155aca60: {'137-17-7': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['137-17-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82544']; candidate_pubchem_cids=[8717, 576305]; selected_pubchem_cids=[8717]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 3,386 | bootstrap_labels | prefLabel | — | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | Bootstrapped prefLabel from legacy name field |
| 3,387 | bootstrap_labels | name | 2,4,5-trimethylbenzenamine | — | Purged legacy name field to enforce prefLabel usage |
| 3,388 | bootstrap_labels | synonyms | [".psi.-Cumidine","1,2,4-Trimethyl-5-aminobenzene","1-Amino-2,4,5-trimethylbenzene","2,4,5-TRIMETHYLANILINE","2,4,5-Tri… | [] | Removed legacy synonyms field in favor of structured labels |
| 95,770 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 95,771 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 214,469 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 230,441 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H13N"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 230,442 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 230,443 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.629D","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['137-17-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82544']; candidate_pubchem_cids=[8717, 576305]; selected_pubchem_cids=[8717]; 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 |
| 249,261 | 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 'CC1=CC(=C(C=C1C)N)C'; added: monoisotopic_mass |
| 259,847 | consensus_match | prefLabel | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAt… | [{"@value":"2,4,5-Trimethylaniline","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribu… | cas=137-17-7; cc_chebi_agreed_name='2,4,5-Trimethylaniline'; object_uuid=fo-a0b4809c155aca60 |
| 259,848 | consensus_match | altLabel | [] | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | cas=137-17-7; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-a0b4809c155aca60 |
| 259,849 | consensus_match | altLabel | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | group_key=2,4,5-trimethylbenzenamine||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=137-17-7; added Common Chemistry CAS names as altLabel: 2,4,5-Trimethylphenylamine, Aniline, 2,4,5-trimethyl-, Benzenamine, 2,4,5-trimethyl-, NSC 37004, NSC 5297, Pseudocumidine, ψ-Cumidine; object_uuid=fo-a0b4809c155aca60 |
| 259,850 | consensus_match | cas_match_labels | — | {"137-17-7":"exactMatch"} | group_key=2,4,5-trimethylbenzenamine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'137-17-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a0b4809c155aca60: {'137-17-7': 'exactMatch'} |
| 274,381 | 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 '2,4,5-Trimethylaniline' |
| 280,811 | 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 'Cc1cc(C)c(N)cc1C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,927 | strip_catalogue_altlabels | altLabel | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | [{"@value":"2,4,5-trimethylbenzenamine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAtt… | Removed 2 catalogue altLabel value(s): 'NSC 37004' (registry code), 'NSC 5297' (registry code) |
| 328,876 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 388,669 | 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 |
| 395,497 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T0609040591070000/3386 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v1 |
| ef:activity/change/20260821T0609040591070000/3387 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v2 |
| ef:activity/change/20260821T0609040591070000/3388 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v3 |
| ef:activity/change/20260821T0609040591070000/95770 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v4 |
| ef:activity/change/20260821T0609040591070000/95771 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v5 |
| ef:activity/change/20260821T0609040591070000/214469 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v6 |
| ef:activity/change/20260821T0609040591070000/230441 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v7 |
| ef:activity/change/20260821T0609040591070000/230442 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v8 |
| ef:activity/change/20260821T0609040591070000/230443 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v9 |
| ef:activity/change/20260821T0609040591070000/249261 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v10 |
| ef:activity/change/20260821T0609040591070000/259847 | prefLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v11 |
| ef:activity/change/20260821T0609040591070000/259848 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v12 |
| ef:activity/change/20260821T0609040591070000/259849 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v13 |
| ef:activity/change/20260821T0609040591070000/259850 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v14 |
| ef:activity/change/20260821T0609040591070000/274381 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v15 |
| ef:activity/change/20260821T0609040591070000/280811 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v16 |
| ef:activity/change/20260821T0609040591070000/287927 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v17 |
| ef:activity/change/20260821T0609040591070000/328876 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v18 |
| ef:activity/change/20260821T0609040591070000/388669 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v19 |
| ef:activity/change/20260821T0609040591070000/395497 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v19 | ef:flow/4d9a8790-3ddd-11dd-9d3f-0050c2490048/v20 |