5-aminoquinoline
Everything that changed this flow. Back to the flow
21179f67-e0cd-4b44-b9fd-56becc91f3bf
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 2 catalogue altLabel value(s): 'NSC 170619' (registry code), 'NSC 27982' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=5-aminoquinoline||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'611-34-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cde8dff28c9ea130: {'611-34-7': '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 lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 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=['611-34-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[11911, 107537, 49761224]; selected_pubchem_cids=[11911]; 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 |
|---|---|---|---|---|---|
| 18,263 | bootstrap_labels | prefLabel | — | [{"@value":"5-aminoquinoline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo… | Bootstrapped prefLabel from legacy name field |
| 18,264 | bootstrap_labels | name | 5-aminoquinoline | — | Purged legacy name field to enforce prefLabel usage |
| 18,265 | bootstrap_labels | synonyms | ["5-aminoquinoline","quinolin-5-amine","5-Quinolinamine","5-Quinolinamine (9CI)","5-Quinolylamine","A0959","AC-2879","A… | [] | Removed legacy synonyms field in favor of structured labels |
| 58,812 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 58,813 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 219,313 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 244,266 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,267 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,268 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J79.730H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['611-34-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[11911, 107537, 49761224]; selected_pubchem_cids=[11911]; 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 |
| 253,240 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | rdkit_pre_consensus from 'C1=CC(=C2C=CC=NC2=C1)N'; added: molecular_mass, monoisotopic_mass |
| 263,044 | consensus_match | altLabel | [] | [{"@value":"(Quinolin-5-yl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | group_key=5-aminoquinoline||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=611-34-7; added Common Chemistry CAS names as altLabel: (Quinolin-5-yl)amine, 5-Quinolinamine, 5-Quinolylamine, NSC 170619, NSC 27982, Quinolin-5-amine, Quinoline, 5-amino-, Quinoline-5-amine; object_uuid=fo-cde8dff28c9ea130 |
| 263,045 | consensus_match | cas_match_labels | — | {"611-34-7":"exactMatch"} | group_key=5-aminoquinoline||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'611-34-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cde8dff28c9ea130: {'611-34-7': 'exactMatch'} |
| 278,449 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '5-aminoquinoline' |
| 285,213 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | rdkit_post_consensus from 'Nc1cccc2ncccc12'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,935 | strip_catalogue_altlabels | altLabel | [{"@value":"(Quinolin-5-yl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | [{"@value":"(Quinolin-5-yl)amine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | Removed 2 catalogue altLabel value(s): 'NSC 170619' (registry code), 'NSC 27982' (registry code) |
| 310,428 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/21179f67-e0cd-… | associations resolved on the elementary layer |
| 392,817 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H8N2"],"… | typed the way the ontology types it |
| 401,464 | 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/20260821T1302361922970000/18263 | prefLabel | ef:agent/bootstrap_labels | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v0 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v1 |
| ef:activity/change/20260821T1302361922970000/18264 | name | ef:agent/bootstrap_labels | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v1 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v2 |
| ef:activity/change/20260821T1302361922970000/18265 | synonyms | ef:agent/bootstrap_labels | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v2 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v3 |
| ef:activity/change/20260821T1302361922970000/58812 | context | ef:agent/default_context_mapping | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v3 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v4 |
| ef:activity/change/20260821T1302361922970000/58813 | context_iri | ef:agent/default_context_mapping | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v4 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v5 |
| ef:activity/change/20260821T1302361922970000/219313 | unit_iri | ef:agent/unit_normalization | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v5 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v6 |
| ef:activity/change/20260821T1302361922970000/244266 | properties | ef:agent/enrich_references | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v6 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v7 |
| ef:activity/change/20260821T1302361922970000/244267 | skos_definition | ef:agent/enrich_references | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v7 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v8 |
| ef:activity/change/20260821T1302361922970000/244268 | references | ef:agent/enrich_references | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v8 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v9 |
| ef:activity/change/20260821T1302361922970000/253240 | properties | ef:agent/rdkit_pre_consensus | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v9 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v10 |
| ef:activity/change/20260821T1302361922970000/263044 | altLabel | ef:agent/consensus_match | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v10 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v11 |
| ef:activity/change/20260821T1302361922970000/263045 | cas_match_labels | ef:agent/consensus_match | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v11 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v12 |
| ef:activity/change/20260821T1302361922970000/278449 | properties | ef:agent/opsin_iupac | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v12 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v13 |
| ef:activity/change/20260821T1302361922970000/285213 | properties | ef:agent/rdkit_post_consensus | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v13 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v14 |
| ef:activity/change/20260821T1302361922970000/290935 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v14 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v15 |
| ef:activity/change/20260821T1302361922970000/310428 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v15 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v16 |
| ef:activity/change/20260821T1302361922970000/392817 | properties | ef:agent/normalise_property_values | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v16 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v17 |
| ef:activity/change/20260821T1302361922970000/401464 | types | ef:agent/link_flows_to_their_substance | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v17 | ef:flow/21179f67-e0cd-4b44-b9fd-56becc91f3bf/v18 |