2',3',4'-trimethoxyacetophenone
Everything that changed this flow. Back to the flow
d2d8ba9a-355b-4f3b-8486-646572386845
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 68811' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2',3',4'-trimethoxyacetophenone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'13909-73-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5e58319d4da550d2: {'13909-73-4': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 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=['13909-73-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[83810, 164088]; selected_pubchem_cids=[83810]; 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 |
|---|---|---|---|---|---|
| 4,777 | bootstrap_labels | prefLabel | — | [{"@value":"2',3',4'-trimethoxyacetophenone","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 4,778 | bootstrap_labels | name | 2',3',4'-trimethoxyacetophenone | — | Purged legacy name field to enforce prefLabel usage |
| 4,779 | bootstrap_labels | synonyms | ["1-(2,3,4-Trimethoxyphenyl)ethanone","1-[2,3,4-tris(methyloxy)phenyl]ethanone","2',3',4' Trimethoxyacetophenone","2,3,… | [] | Removed legacy synonyms field in favor of structured labels |
| 174,676 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 174,677 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 214,935 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 231,772 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,773 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,774 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J60.319H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['13909-73-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[83810, 164088]; selected_pubchem_cids=[83810]; 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 |
| 249,635 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | rdkit_pre_consensus from 'CC(=O)C1=C(C(=C(C=C1)OC)OC)OC'; added: molecular_mass, monoisotopic_mass |
| 259,405 | consensus_match | altLabel | [] | [{"@value":"1-(2,3,4-Trimethoxyphenyl)ethan-1-one","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | group_key=2',3',4'-trimethoxyacetophenone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=13909-73-4; added Common Chemistry CAS names as altLabel: 1-(2,3,4-Trimethoxyphenyl)ethan-1-one, 1-(2,3,4-Trimethoxyphenyl)ethanone, 2′,3′,4′-Trimethoxyacetophenone, Acetophenone, 2′,3′,4′-trimethoxy-, Ethanone, 1-(2,3,4-trimethoxyphenyl)-, Methyl 2,3,4-trimethoxyphenyl ketone, NSC 68811, Tri-<em>O</em>-methylgallacetophenone; object_uuid=fo-5e58319d4da550d2 |
| 259,406 | consensus_match | cas_match_labels | — | {"13909-73-4":"exactMatch"} | group_key=2',3',4'-trimethoxyacetophenone||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'13909-73-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5e58319d4da550d2: {'13909-73-4': 'exactMatch'} |
| 274,765 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2',3',4'-trimethoxyacetophenone' |
| 281,230 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | rdkit_post_consensus from 'COc1ccc(C(C)=O)c(OC)c1OC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,228 | strip_catalogue_altlabels | altLabel | [{"@value":"1-(2,3,4-Trimethoxyphenyl)ethan-1-one","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | [{"@value":"1-(2,3,4-Trimethoxyphenyl)ethan-1-one","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","… | Removed 1 catalogue altLabel value(s): 'NSC 68811' (registry code) |
| 368,355 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d2d8ba9a-355b-… | associations resolved on the elementary layer |
| 389,070 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C11H14O4"]… | typed the way the ontology types it |
| 396,071 | 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/20260821T0609040591070000/4777 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v0 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v1 |
| ef:activity/change/20260821T0609040591070000/4778 | name | ef:agent/bootstrap_labels | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v1 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v2 |
| ef:activity/change/20260821T0609040591070000/4779 | synonyms | ef:agent/bootstrap_labels | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v2 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v3 |
| ef:activity/change/20260821T0609040591070000/174676 | context | ef:agent/default_context_mapping | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v3 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v4 |
| ef:activity/change/20260821T0609040591070000/174677 | context_iri | ef:agent/default_context_mapping | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v4 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v5 |
| ef:activity/change/20260821T0609040591070000/214935 | unit_iri | ef:agent/unit_normalization | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v5 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v6 |
| ef:activity/change/20260821T0609040591070000/231772 | properties | ef:agent/enrich_references | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v6 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v7 |
| ef:activity/change/20260821T0609040591070000/231773 | skos_definition | ef:agent/enrich_references | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v7 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v8 |
| ef:activity/change/20260821T0609040591070000/231774 | references | ef:agent/enrich_references | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v8 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v9 |
| ef:activity/change/20260821T0609040591070000/249635 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v9 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v10 |
| ef:activity/change/20260821T0609040591070000/259405 | altLabel | ef:agent/consensus_match | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v10 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v11 |
| ef:activity/change/20260821T0609040591070000/259406 | cas_match_labels | ef:agent/consensus_match | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v11 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v12 |
| ef:activity/change/20260821T0609040591070000/274765 | properties | ef:agent/opsin_iupac | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v12 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v13 |
| ef:activity/change/20260821T0609040591070000/281230 | properties | ef:agent/rdkit_post_consensus | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v13 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v14 |
| ef:activity/change/20260821T0609040591070000/288228 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v14 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v15 |
| ef:activity/change/20260821T0609040591070000/368355 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v15 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v16 |
| ef:activity/change/20260821T0609040591070000/389070 | properties | ef:agent/normalise_property_values | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v16 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v17 |
| ef:activity/change/20260821T0609040591070000/396071 | types | ef:agent/link_flows_to_their_substance | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v17 | ef:flow/d2d8ba9a-355b-4f3b-8486-646572386845/v18 |