(3-aminophenyl)uronium Chloride
Everything that changed this flow. Back to the flow
715dbb0f-175e-4e95-bef5-31f0e72c0698
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=(3-aminophenyl)uroniumchloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'59690-88-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b26b0d4a184da2e8: {'59690-88-9': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['59690-88-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[108805, 108806, 265981]; selected_pubchem_cids=[108805]; 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 |
|---|---|---|---|---|---|
| 10,866 | bootstrap_labels | prefLabel | — | [{"@value":"(3-aminophenyl)uronium chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 10,867 | bootstrap_labels | name | (3-aminophenyl)uronium chloride | — | Purged legacy name field to enforce prefLabel usage |
| 10,868 | bootstrap_labels | synonyms | ["organic","(3-aminophenyl)uroniumchloride"] | [] | Removed legacy synonyms field in favor of structured labels |
| 117,266 | 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 |
| 117,267 | 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 |
| 216,948 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,635 | normalize_name_case | prefLabel | [{"@value":"(3-aminophenyl)uronium chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | [{"@value":"(3-aminophenyl)uronium Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 237,526 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 237,527 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 237,528 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.056.217","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['59690-88-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[108805, 108806, 265981]; selected_pubchem_cids=[108805]; 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 |
| 251,290 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)NC(=O)N)N.Cl'; added: molecular_mass, monoisotopic_mass |
| 257,714 | consensus_match | altLabel | [] | [{"@value":"(3-Aminophenyl)-urea hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | group_key=(3-aminophenyl)uroniumchloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=59690-88-9; added Common Chemistry CAS names as altLabel: (3-Aminophenyl)-urea hydrochloride, (3-Aminophenyl)-urea monohydrochloride, 1-(3-Aminophenyl)urea hydrochloride, Urea, (3-aminophenyl)-, monohydrochloride, Urea, <em>N</em>-(3-aminophenyl)-, hydrochloride (1:1); object_uuid=fo-b26b0d4a184da2e8 |
| 257,715 | consensus_match | cas_match_labels | — | {"59690-88-9":"exactMatch"} | group_key=(3-aminophenyl)uroniumchloride||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'59690-88-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-b26b0d4a184da2e8: {'59690-88-9': 'exactMatch'} |
| 276,489 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(3-aminophenyl)uronium Chloride' |
| 283,096 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | rdkit_post_consensus from 'NC(O)=[NH+]c1cccc(N)c1.[Cl-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,557 | dedupe_altlabels | altLabel | [{"@value":"(3-Aminophenyl)-urea hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | [{"@value":"(3-Aminophenyl)-urea hydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | Deduplicated altLabel values and removed entries matching prefLabel |
| 339,651 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/715dbb0f-175e-… | associations resolved on the elementary layer |
| 390,846 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H10ClN3O… | typed the way the ontology types it |
| 398,631 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260820T0738569779880000/10866 | prefLabel | ef:agent/bootstrap_labels | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v0 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v1 |
| ef:activity/change/20260820T0738569779880000/10867 | name | ef:agent/bootstrap_labels | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v1 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v2 |
| ef:activity/change/20260820T0738569779880000/10868 | synonyms | ef:agent/bootstrap_labels | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v2 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v3 |
| ef:activity/change/20260820T0738569779880000/117266 | context | ef:agent/default_context_mapping | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v3 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v4 |
| ef:activity/change/20260820T0738569779880000/117267 | context_iri | ef:agent/default_context_mapping | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v4 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v5 |
| ef:activity/change/20260820T0738569779880000/216948 | unit_iri | ef:agent/unit_normalization | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v5 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v6 |
| ef:activity/change/20260820T0738569779880000/223635 | prefLabel | ef:agent/normalize_name_case | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v6 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v7 |
| ef:activity/change/20260820T0738569779880000/237526 | properties | ef:agent/enrich_references | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v7 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v8 |
| ef:activity/change/20260820T0738569779880000/237527 | skos_definition | ef:agent/enrich_references | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v8 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v9 |
| ef:activity/change/20260820T0738569779880000/237528 | references | ef:agent/enrich_references | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v9 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v10 |
| ef:activity/change/20260820T0738569779880000/251290 | properties | ef:agent/rdkit_pre_consensus | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v10 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v11 |
| ef:activity/change/20260820T0738569779880000/257714 | altLabel | ef:agent/consensus_match | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v11 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v12 |
| ef:activity/change/20260820T0738569779880000/257715 | cas_match_labels | ef:agent/consensus_match | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v12 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v13 |
| ef:activity/change/20260820T0738569779880000/276489 | properties | ef:agent/opsin_iupac | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v13 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v14 |
| ef:activity/change/20260820T0738569779880000/283096 | properties | ef:agent/rdkit_post_consensus | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v14 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v15 |
| ef:activity/change/20260820T0738569779880000/292557 | altLabel | ef:agent/dedupe_altlabels | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v15 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v16 |
| ef:activity/change/20260820T0738569779880000/339651 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v16 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v17 |
| ef:activity/change/20260820T0738569779880000/390846 | properties | ef:agent/normalise_property_values | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v17 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v18 |
| ef:activity/change/20260820T0738569779880000/398631 | types | ef:agent/link_flows_to_their_substance | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v18 | ef:flow/715dbb0f-175e-4e95-bef5-31f0e72c0698/v19 |