4-aminoquinoline-1-oxide
Everything that changed this flow. Back to the flow
a14c8431-8fff-4c1c-a0ee-f56a1331e974
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| altLabel | 1 | consensus_match | group_key=4-aminoquinoline-1-oxide||dimension=Environmental > media=Air > strata=Long-term; cas=2508-86-3; added Common Chemistry CAS names as altLabel: 4-Aminoquinoline 1-oxide, 4-Quinolinamine, 1-oxide, Quinoline, 4-amino-, 1-oxide; object_uuid=fo-5ceddee18c9aaacd |
| cas_match_labels | 1 | consensus_match | group_key=4-aminoquinoline-1-oxide||dimension=Environmental > media=Air > strata=Long-term; group_sources=['pubchem']; cas_sources={'2508-86-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5ceddee18c9aaacd: {'2508-86-3': '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 fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 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=['2508-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[90499, 135874]; selected_pubchem_cids=[135874]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 14,433 | bootstrap_labels | prefLabel | — | [{"@value":"4-aminoquinoline-1-oxide","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 14,434 | bootstrap_labels | name | 4-aminoquinoline-1-oxide | — | Purged legacy name field to enforce prefLabel usage |
| 14,435 | bootstrap_labels | synonyms | ["1-hydroxyquinolin-4-imine","4-Aminoquinoline 1-oxide","4-Quinolinamine, 1-oxide","4-Quinolinamine, 1-oxide (9CI)","AC… | [] | Removed legacy synonyms field in favor of structured labels |
| 145,718 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 145,719 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 218,103 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 240,844 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,845 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,846 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.159H","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['2508-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[90499, 135874]; selected_pubchem_cids=[135874]; 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 |
| 252,251 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | rdkit_pre_consensus from 'C1=CC=C2C(=C1)C(=N)C=CN2O'; added: molecular_mass, monoisotopic_mass |
| 262,586 | consensus_match | altLabel | [] | [{"@value":"4-Aminoquinoline 1-oxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | group_key=4-aminoquinoline-1-oxide||dimension=Environmental > media=Air > strata=Long-term; cas=2508-86-3; added Common Chemistry CAS names as altLabel: 4-Aminoquinoline 1-oxide, 4-Quinolinamine, 1-oxide, Quinoline, 4-amino-, 1-oxide; object_uuid=fo-5ceddee18c9aaacd |
| 262,587 | consensus_match | cas_match_labels | — | {"2508-86-3":"exactMatch"} | group_key=4-aminoquinoline-1-oxide||dimension=Environmental > media=Air > strata=Long-term; group_sources=['pubchem']; cas_sources={'2508-86-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5ceddee18c9aaacd: {'2508-86-3': 'exactMatch'} |
| 277,446 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-aminoquinoline-1-oxide' |
| 284,131 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | rdkit_post_consensus from 'Nc1cc[n+]([O-])c2ccccc12'; added: inchi2d_key_string; confirmed: smiles_string, inchi2d_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,043 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2O"],… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 353,861 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/a14c8431-8fff-… | associations resolved on the elementary layer |
| 399,993 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260821T1554374006150000/14433 | prefLabel | ef:agent/bootstrap_labels | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v0 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v1 |
| ef:activity/change/20260821T1554374006150000/14434 | name | ef:agent/bootstrap_labels | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v1 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v2 |
| ef:activity/change/20260821T1554374006150000/14435 | synonyms | ef:agent/bootstrap_labels | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v2 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v3 |
| ef:activity/change/20260821T1554374006150000/145718 | context | ef:agent/default_context_mapping | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v3 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v4 |
| ef:activity/change/20260821T1554374006150000/145719 | context_iri | ef:agent/default_context_mapping | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v4 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v5 |
| ef:activity/change/20260821T1554374006150000/218103 | unit_iri | ef:agent/unit_normalization | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v5 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v6 |
| ef:activity/change/20260821T1554374006150000/240844 | properties | ef:agent/enrich_references | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v6 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v7 |
| ef:activity/change/20260821T1554374006150000/240845 | skos_definition | ef:agent/enrich_references | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v7 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v8 |
| ef:activity/change/20260821T1554374006150000/240846 | references | ef:agent/enrich_references | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v8 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v9 |
| ef:activity/change/20260821T1554374006150000/252251 | properties | ef:agent/rdkit_pre_consensus | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v9 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v10 |
| ef:activity/change/20260821T1554374006150000/262586 | altLabel | ef:agent/consensus_match | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v10 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v11 |
| ef:activity/change/20260821T1554374006150000/262587 | cas_match_labels | ef:agent/consensus_match | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v11 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v12 |
| ef:activity/change/20260821T1554374006150000/277446 | properties | ef:agent/opsin_iupac | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v12 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v13 |
| ef:activity/change/20260821T1554374006150000/284131 | properties | ef:agent/rdkit_post_consensus | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v13 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v14 |
| ef:activity/change/20260821T1554374006150000/287043 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v14 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v15 |
| ef:activity/change/20260821T1554374006150000/353861 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v15 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v16 |
| ef:activity/change/20260821T1554374006150000/399993 | types | ef:agent/link_flows_to_their_substance | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v16 | ef:flow/a14c8431-8fff-4c1c-a0ee-f56a1331e974/v17 |