2,3,6-trichloroanisole
Everything that changed this flow. Back to the flow
a28e2e20-9f80-4093-844c-a71c424d10c6
By field
14 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 | 1 | consensus_match | group_key=2,3,6-trichloroanisole||dimension=Environmental > media=Water > water_body=Unknown; cas=50375-10-5; added Common Chemistry CAS names as altLabel: 1,2,4-Trichloro-3-methoxybenzene, Benzene, 1,2,4-trichloro-3-methoxy-; object_uuid=fo-9bdcfc20f651ee85 |
| cas_match_labels | 1 | consensus_match | group_key=2,3,6-trichloroanisole||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'50375-10-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9bdcfc20f651ee85: {'50375-10-5': '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 |
| 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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 256-561-9 from CAS 50375-10-5 |
| 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=['50375-10-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[39656]; selected_pubchem_cids=[39656]; 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 |
|---|---|---|---|---|---|
| 20,458 | bootstrap_labels | prefLabel | — | [{"@value":"2,3,6-trichloroanisole","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttrib… | Bootstrapped prefLabel from legacy name field |
| 20,459 | bootstrap_labels | name | 2,3,6-trichloroanisole | — | Purged legacy name field to enforce prefLabel usage |
| 20,460 | bootstrap_labels | synonyms | ["1,2,4-Trichloro-3-methoxybenzene","AC1L2267","Benzene, 1,2,4-trichloro-3-methoxy-"] | [] | Removed legacy synonyms field in favor of structured labels |
| 146,572 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 146,573 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 219,963 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 227,048 | ec_cross_check | ec_numbers | [] | ["256-561-9"] | Resolved from EC-inventory: 256-561-9 from CAS 50375-10-5 |
| 246,079 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,080 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,081 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J209.017A","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['50375-10-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[39656]; selected_pubchem_cids=[39656]; 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 |
| 253,768 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | rdkit_pre_consensus from 'COC1=C(C=CC(=C1Cl)Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 259,737 | consensus_match | altLabel | [] | [{"@value":"1,2,4-Trichloro-3-methoxybenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | group_key=2,3,6-trichloroanisole||dimension=Environmental > media=Water > water_body=Unknown; cas=50375-10-5; added Common Chemistry CAS names as altLabel: 1,2,4-Trichloro-3-methoxybenzene, Benzene, 1,2,4-trichloro-3-methoxy-; object_uuid=fo-9bdcfc20f651ee85 |
| 259,738 | consensus_match | cas_match_labels | — | {"50375-10-5":"exactMatch"} | group_key=2,3,6-trichloroanisole||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'50375-10-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9bdcfc20f651ee85: {'50375-10-5': 'exactMatch'} |
| 278,968 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,3,6-trichloroanisole' |
| 285,787 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | rdkit_post_consensus from 'COc1c(Cl)ccc(Cl)c1Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 354,301 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/a28e2e20-9f80-… | associations resolved on the elementary layer |
| 393,345 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H5Cl3O"]… | typed the way the ontology types it |
| 402,263 | 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/20260821T0609040591070000/20458 | prefLabel | ef:agent/bootstrap_labels | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v0 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v1 |
| ef:activity/change/20260821T0609040591070000/20459 | name | ef:agent/bootstrap_labels | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v1 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v2 |
| ef:activity/change/20260821T0609040591070000/20460 | synonyms | ef:agent/bootstrap_labels | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v2 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v3 |
| ef:activity/change/20260821T0609040591070000/146572 | context | ef:agent/default_context_mapping | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v3 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v4 |
| ef:activity/change/20260821T0609040591070000/146573 | context_iri | ef:agent/default_context_mapping | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v4 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v5 |
| ef:activity/change/20260821T0609040591070000/219963 | unit_iri | ef:agent/unit_normalization | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v5 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v6 |
| ef:activity/change/20260821T0609040591070000/227048 | ec_numbers | ef:agent/ec_cross_check | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v6 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v7 |
| ef:activity/change/20260821T0609040591070000/246079 | properties | ef:agent/enrich_references | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v7 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v8 |
| ef:activity/change/20260821T0609040591070000/246080 | skos_definition | ef:agent/enrich_references | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v8 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v9 |
| ef:activity/change/20260821T0609040591070000/246081 | references | ef:agent/enrich_references | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v9 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v10 |
| ef:activity/change/20260821T0609040591070000/253768 | properties | ef:agent/rdkit_pre_consensus | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v10 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v11 |
| ef:activity/change/20260821T0609040591070000/259737 | altLabel | ef:agent/consensus_match | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v11 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v12 |
| ef:activity/change/20260821T0609040591070000/259738 | cas_match_labels | ef:agent/consensus_match | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v12 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v13 |
| ef:activity/change/20260821T0609040591070000/278968 | properties | ef:agent/opsin_iupac | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v13 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v14 |
| ef:activity/change/20260821T0609040591070000/285787 | properties | ef:agent/rdkit_post_consensus | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v14 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v15 |
| ef:activity/change/20260821T0609040591070000/354301 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v15 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v16 |
| ef:activity/change/20260821T0609040591070000/393345 | properties | ef:agent/normalise_property_values | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v16 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v17 |
| ef:activity/change/20260821T0609040591070000/402263 | types | ef:agent/link_flows_to_their_substance | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v17 | ef:flow/a28e2e20-9f80-4093-844c-a71c424d10c6/v18 |