3-phenylbutanal
Everything that changed this flow. Back to the flow
6d158807-59f0-428b-ae34-a2d748eb7f3e
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=3-phenylbutanal||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'16251-77-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4b863ef8e9c125b0: {'16251-77-7': '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 water > Emissions to water, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, 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=['16251-77-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[85979]; selected_pubchem_cids=[85979]; 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 |
|---|---|---|---|---|---|
| 5,935 | bootstrap_labels | prefLabel | — | [{"@value":"3-phenylbutanal","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 5,936 | bootstrap_labels | name | 3-phenylbutanal | — | Purged legacy name field to enforce prefLabel usage |
| 5,937 | bootstrap_labels | synonyms | ["organic","3-phenylbutyraldehyde","trifernal"] | [] | Removed legacy synonyms field in favor of structured labels |
| 114,732 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 114,733 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 215,322 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,888 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,889 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,890 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J82.489E","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['16251-77-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[85979]; selected_pubchem_cids=[85979]; 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 |
| 249,960 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | rdkit_pre_consensus from 'CC(CC=O)C1=CC=CC=C1'; added: molecular_mass, monoisotopic_mass |
| 262,192 | consensus_match | altLabel | [] | [{"@value":"(<em>RS</em>)-3-Phenylbutanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=3-phenylbutanal||dimension=Environmental > media=Air > strata=Long-term; cas=16251-77-7; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-3-Phenylbutanal, (±)-3-Phenylbutyraldehyde, 3-Methyl-3-phenylpropionaldehyde, 3-Phenyl-1-butanal, 3-Phenylbutylaldehyde, 3-Phenylbutyraldehyde, Benzenepropanal, β-methyl-, Hydrocinnamaldehyde, β-methyl-, Trifernal, β-Methylbenzenepropanal; object_uuid=fo-4b863ef8e9c125b0 |
| 262,193 | consensus_match | cas_match_labels | — | {"16251-77-7":"exactMatch"} | group_key=3-phenylbutanal||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'16251-77-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-4b863ef8e9c125b0: {'16251-77-7': 'exactMatch'} |
| 275,093 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-phenylbutanal' |
| 281,589 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | rdkit_post_consensus from 'CC(CC=O)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,295 | dedupe_altlabels | altLabel | [{"@value":"(<em>RS</em>)-3-Phenylbutanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"(RS)-3-Phenylbutanal","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | Deduplicated altLabel values and removed entries matching prefLabel |
| 338,365 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6d158807-59f0-… | associations resolved on the elementary layer |
| 389,402 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H12O"],… | typed the way the ontology types it |
| 396,538 | 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/20260821T1302361922970000/5935 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v0 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v1 |
| ef:activity/change/20260821T1302361922970000/5936 | name | ef:agent/bootstrap_labels | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v1 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v2 |
| ef:activity/change/20260821T1302361922970000/5937 | synonyms | ef:agent/bootstrap_labels | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v2 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v3 |
| ef:activity/change/20260821T1302361922970000/114732 | context | ef:agent/default_context_mapping | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v3 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v4 |
| ef:activity/change/20260821T1302361922970000/114733 | context_iri | ef:agent/default_context_mapping | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v4 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v5 |
| ef:activity/change/20260821T1302361922970000/215322 | unit_iri | ef:agent/unit_normalization | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v5 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v6 |
| ef:activity/change/20260821T1302361922970000/232888 | properties | ef:agent/enrich_references | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v6 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v7 |
| ef:activity/change/20260821T1302361922970000/232889 | skos_definition | ef:agent/enrich_references | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v7 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v8 |
| ef:activity/change/20260821T1302361922970000/232890 | references | ef:agent/enrich_references | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v8 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v9 |
| ef:activity/change/20260821T1302361922970000/249960 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v9 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v10 |
| ef:activity/change/20260821T1302361922970000/262192 | altLabel | ef:agent/consensus_match | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v10 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v11 |
| ef:activity/change/20260821T1302361922970000/262193 | cas_match_labels | ef:agent/consensus_match | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v11 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v12 |
| ef:activity/change/20260821T1302361922970000/275093 | properties | ef:agent/opsin_iupac | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v12 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v13 |
| ef:activity/change/20260821T1302361922970000/281589 | properties | ef:agent/rdkit_post_consensus | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v13 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v14 |
| ef:activity/change/20260821T1302361922970000/292295 | altLabel | ef:agent/dedupe_altlabels | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v14 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v15 |
| ef:activity/change/20260821T1302361922970000/338365 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v15 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v16 |
| ef:activity/change/20260821T1302361922970000/389402 | properties | ef:agent/normalise_property_values | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v16 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v17 |
| ef:activity/change/20260821T1302361922970000/396538 | types | ef:agent/link_flows_to_their_substance | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v17 | ef:flow/6d158807-59f0-428b-ae34-a2d748eb7f3e/v18 |