4-isopropylaniline
Everything that changed this flow. Back to the flow
64094c00-a82e-4fcb-bc8f-7dc8b53fe26d
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 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 7198' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=4-isopropylaniline||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'99-88-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b1643f97c3194ed8: {'99-88-7': '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 |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['99-88-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_43405']; candidate_pubchem_cids=[7464, 11504, 707035]; selected_pubchem_cids=[7464]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 4,847 | bootstrap_labels | prefLabel | — | [{"@value":"4-isopropylaniline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 4,848 | bootstrap_labels | name | 4-isopropylaniline | — | Purged legacy name field to enforce prefLabel usage |
| 4,849 | bootstrap_labels | synonyms | ["organic","4-isopropylaniline","4-amino-1-isopropylbenzene","4-aminocumene","benzenamine,4-(1-methylethyl)-","beta-(4-… | [] | Removed legacy synonyms field in favor of structured labels |
| 109,102 | 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 |
| 109,103 | 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 |
| 214,958 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 231,834 | 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) |
| 231,835 | enrich_references | skos_definition | — | [{"@value":"A substituted aniline carrying an isopropyl group at position 4. It is a metabolite of isoproturon.","@lang… | Merged ChEBI/PubChem definitions into skos:definition |
| 231,836 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J11.624F","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['99-88-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_43405']; candidate_pubchem_cids=[7464, 11504, 707035]; selected_pubchem_cids=[7464]; 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 |
| 249,652 | 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 'CC(C)C1=CC=C(C=C1)N'; added: monoisotopic_mass |
| 254,991 | chebi_altlabels | altLabel | [] | [{"@value":"4-(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 262,771 | consensus_match | altLabel | [{"@value":"4-(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | [{"@value":"4-(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | group_key=4-isopropylaniline||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=99-88-7; added Common Chemistry CAS names as altLabel: 1-Amino-4-isopropylbenzene, 4-(1-Methylethyl)benzenamine, 4-(2-Propyl)aniline, 4-Aminoisopropylbenzene, 4-Isopropylbenzenamine, 4-Isopropylphenylamine, <em>p</em>-Aminocumene, <em>p</em>-Isopropylaniline, Benzenamine, 4-(1-methylethyl)-, NSC 7198, [4-(1-Methylethyl)phenyl]amine, β-(4-Aminophenyl)propane; object_uuid=fo-b1643f97c3194ed8 |
| 262,772 | consensus_match | cas_match_labels | — | {"99-88-7":"exactMatch"} | group_key=4-isopropylaniline||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'99-88-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b1643f97c3194ed8: {'99-88-7': 'exactMatch'} |
| 274,785 | 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 '4-isopropylaniline' |
| 281,255 | 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 'CC(C)c1ccc(N)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,250 | strip_catalogue_altlabels | altLabel | [{"@value":"4-(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | [{"@value":"4-(1-methylethyl)aniline","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | Removed 1 catalogue altLabel value(s): 'NSC 7198' (registry code) |
| 335,549 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/64094c00-a82e-… | associations resolved on the elementary layer |
| 389,094 | 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 |
| 396,107 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260821T1554374006150000/4847 | prefLabel | ef:agent/bootstrap_labels | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v0 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v1 |
| ef:activity/change/20260821T1554374006150000/4848 | name | ef:agent/bootstrap_labels | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v1 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v2 |
| ef:activity/change/20260821T1554374006150000/4849 | synonyms | ef:agent/bootstrap_labels | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v2 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v3 |
| ef:activity/change/20260821T1554374006150000/109102 | context | ef:agent/default_context_mapping | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v3 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v4 |
| ef:activity/change/20260821T1554374006150000/109103 | context_iri | ef:agent/default_context_mapping | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v4 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v5 |
| ef:activity/change/20260821T1554374006150000/214958 | unit_iri | ef:agent/unit_normalization | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v5 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v6 |
| ef:activity/change/20260821T1554374006150000/231834 | properties | ef:agent/enrich_references | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v6 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v7 |
| ef:activity/change/20260821T1554374006150000/231835 | skos_definition | ef:agent/enrich_references | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v7 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v8 |
| ef:activity/change/20260821T1554374006150000/231836 | references | ef:agent/enrich_references | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v8 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v9 |
| ef:activity/change/20260821T1554374006150000/249652 | properties | ef:agent/rdkit_pre_consensus | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v9 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v10 |
| ef:activity/change/20260821T1554374006150000/254991 | altLabel | ef:agent/chebi_altlabels | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v10 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v11 |
| ef:activity/change/20260821T1554374006150000/262771 | altLabel | ef:agent/consensus_match | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v11 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v12 |
| ef:activity/change/20260821T1554374006150000/262772 | cas_match_labels | ef:agent/consensus_match | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v12 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v13 |
| ef:activity/change/20260821T1554374006150000/274785 | properties | ef:agent/opsin_iupac | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v13 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v14 |
| ef:activity/change/20260821T1554374006150000/281255 | properties | ef:agent/rdkit_post_consensus | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v14 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v15 |
| ef:activity/change/20260821T1554374006150000/288250 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v15 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v16 |
| ef:activity/change/20260821T1554374006150000/335549 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v16 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v17 |
| ef:activity/change/20260821T1554374006150000/389094 | properties | ef:agent/normalise_property_values | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v17 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v18 |
| ef:activity/change/20260821T1554374006150000/396107 | types | ef:agent/link_flows_to_their_substance | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v18 | ef:flow/64094c00-a82e-4fcb-bc8f-7dc8b53fe26d/v19 |