1,3,5-trimethylbenzene
Everything that changed this flow. Back to the flow
f214ae26-6555-11dd-ad8b-0800200c9a66
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 9273' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1,3,5-trimethylbenzene||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-67-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c10e4c79e4578efc: {'108-67-8': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 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=['108-67-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34833']; candidate_pubchem_cids=[7947, 17244968]; selected_pubchem_cids=[7947]; 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 |
|---|---|---|---|---|---|
| 14,529 | bootstrap_labels | prefLabel | — | [{"@value":"1,3,5-trimethylbenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | Bootstrapped prefLabel from legacy name field |
| 14,530 | bootstrap_labels | name | 1,3,5-trimethylbenzene | — | Purged legacy name field to enforce prefLabel usage |
| 25,699 | bootstrap_labels | synonyms | ["3,5-Dimethyltoluene","AC1L1PX3","AKOS000120144","BENZENE,1,3,5-TRIMETHYL","Benzene, 1,3,5-trimethyl-","Fleet-X","Jsp0… | [] | Removed legacy synonyms field in favor of structured labels |
| 194,786 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 194,787 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 218,135 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 240,939 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 240,940 | enrich_references | skos_definition | — | [{"@value":"A trimethylbenzene carrying methyl substituents at positions 1, 3 and 5.","@language":"en","provenance":{"p… | Merged ChEBI/PubChem definitions into skos:definition |
| 240,941 | enrich_references | references | [] | [{"@id":"gmelin:2956","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"conse… | Added references with provenance; cas_numbers=['108-67-8']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_34833']; candidate_pubchem_cids=[7947, 17244968]; selected_pubchem_cids=[7947]; 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 |
| 256,326 | chebi_altlabels | altLabel | [] | [{"@value":"3,5-dimethyltoluene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Added 4 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 258,480 | consensus_match | altLabel | [{"@value":"3,5-dimethyltoluene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"3,5-dimethyltoluene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | group_key=1,3,5-trimethylbenzene||dimension=Environmental > media=Air > indoor=Unknown; cas=108-67-8; added Common Chemistry CAS names as altLabel: 2,4,6-Trimethylbenzene, Benzene, 1,3,5-trimethyl-, NSC 9273; object_uuid=fo-c10e4c79e4578efc |
| 258,481 | consensus_match | cas_match_labels | — | {"108-67-8":"exactMatch"} | group_key=1,3,5-trimethylbenzene||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'108-67-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c10e4c79e4578efc: {'108-67-8': 'exactMatch'} |
| 277,473 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3,5-trimethylbenzene' |
| 284,157 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | rdkit_post_consensus from 'Cc1cc(C)cc(C)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,229 | strip_catalogue_altlabels | altLabel | [{"@value":"3,5-dimethyltoluene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | [{"@value":"3,5-dimethyltoluene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributed… | Removed 1 catalogue altLabel value(s): 'NSC 9273' (registry code) |
| 378,418 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/f214ae26-6555-… | associations resolved on the elementary layer |
| 391,821 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H12"],"a… | typed the way the ontology types it |
| 400,020 | 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/20260820T1812399309960000/14529 | prefLabel | ef:agent/bootstrap_labels | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v0 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v1 |
| ef:activity/change/20260820T1812399309960000/14530 | name | ef:agent/bootstrap_labels | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v1 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v2 |
| ef:activity/change/20260820T1812399309960000/25699 | synonyms | ef:agent/bootstrap_labels | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v2 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v3 |
| ef:activity/change/20260820T1812399309960000/194786 | context | ef:agent/default_context_mapping | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v3 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v4 |
| ef:activity/change/20260820T1812399309960000/194787 | context_iri | ef:agent/default_context_mapping | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v4 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v5 |
| ef:activity/change/20260820T1812399309960000/218135 | unit_iri | ef:agent/unit_normalization | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v5 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v6 |
| ef:activity/change/20260820T1812399309960000/240939 | properties | ef:agent/enrich_references | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v6 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v7 |
| ef:activity/change/20260820T1812399309960000/240940 | skos_definition | ef:agent/enrich_references | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v7 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v8 |
| ef:activity/change/20260820T1812399309960000/240941 | references | ef:agent/enrich_references | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v8 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v9 |
| ef:activity/change/20260820T1812399309960000/256326 | altLabel | ef:agent/chebi_altlabels | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v9 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v10 |
| ef:activity/change/20260820T1812399309960000/258480 | altLabel | ef:agent/consensus_match | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v10 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v11 |
| ef:activity/change/20260820T1812399309960000/258481 | cas_match_labels | ef:agent/consensus_match | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v11 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v12 |
| ef:activity/change/20260820T1812399309960000/277473 | properties | ef:agent/opsin_iupac | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v12 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v13 |
| ef:activity/change/20260820T1812399309960000/284157 | properties | ef:agent/rdkit_post_consensus | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v13 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v14 |
| ef:activity/change/20260820T1812399309960000/290229 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v14 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v15 |
| ef:activity/change/20260820T1812399309960000/378418 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v15 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v16 |
| ef:activity/change/20260820T1812399309960000/391821 | properties | ef:agent/normalise_property_values | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v16 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v17 |
| ef:activity/change/20260820T1812399309960000/400020 | types | ef:agent/link_flows_to_their_substance | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v17 | ef:flow/f214ae26-6555-11dd-ad8b-0800200c9a66/v18 |