Isonicotinaldehyde Oxime
Everything that changed this flow. Back to the flow
e28a55fd-333b-4fb0-b9b4-fd90cc627b27
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 1 catalogue altLabel value(s): 'NSC 63847' (registry code) |
| 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=isonicotinaldehydeoxime||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'696-54-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dc5307e163727452: {'696-54-8': '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 air, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['696-54-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[12764, 135460230, 135465065]; selected_pubchem_cids=[12764]; 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 |
|---|---|---|---|---|---|
| 1,262 | bootstrap_labels | prefLabel | — | [{"@value":"isonicotinaldehyde oxime","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 1,263 | bootstrap_labels | name | isonicotinaldehyde oxime | — | Purged legacy name field to enforce prefLabel usage |
| 25,304 | bootstrap_labels | synonyms | ["isonicotinaldehydeoxime","(e)-n-(pyridin-4-ylmethylidene)hydroxylamine","pyridine-4-aldoxime","(E)-N-hydroxy-1-(pyrid… | [] | Removed legacy synonyms field in favor of structured labels |
| 184,652 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 184,653 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 213,762 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,389 | normalize_name_case | prefLabel | [{"@value":"isonicotinaldehyde oxime","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | [{"@value":"Isonicotinaldehyde Oxime","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,396 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,397 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,398 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.010.725","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['696-54-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[12764, 135460230, 135465065]; selected_pubchem_cids=[12764]; 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 |
| 248,673 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | rdkit_pre_consensus from 'C1=CN=CC=C1C=NO'; added: molecular_mass, monoisotopic_mass |
| 268,125 | consensus_match | altLabel | [] | [{"@value":"4-(Hydroxyiminomethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | group_key=isonicotinaldehydeoxime||dimension=Environmental > media=Water > water_body=Ocean; cas=696-54-8; added Common Chemistry CAS names as altLabel: 4-(Hydroxyiminomethyl)pyridine, 4-Pyridinaldoxime, 4-Pyridinealdoxime, 4-Pyridinecarboxaldehyde, oxime, Isonicotinaldehyde, oxime, NSC 63847, Pyridine-4-carboxaldoxime; object_uuid=fo-dc5307e163727452 |
| 268,126 | consensus_match | cas_match_labels | — | {"696-54-8":"exactMatch"} | group_key=isonicotinaldehydeoxime||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['ec_inventory', 'pubchem']; cas_sources={'696-54-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-dc5307e163727452: {'696-54-8': 'exactMatch'} |
| 273,810 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Isonicotinaldehyde Oxime' |
| 280,192 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | rdkit_post_consensus from 'ON=Cc1ccncc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,534 | strip_catalogue_altlabels | altLabel | [{"@value":"4-(Hydroxyiminomethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | [{"@value":"4-(Hydroxyiminomethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | Removed 1 catalogue altLabel value(s): 'NSC 63847' (registry code) |
| 373,375 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e28a55fd-333b-… | associations resolved on the elementary layer |
| 388,093 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6N2O"],… | typed the way the ontology types it |
| 394,690 | 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/20260820T1555490862250000/1262 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v0 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v1 |
| ef:activity/change/20260820T1555490862250000/1263 | name | ef:agent/bootstrap_labels | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v1 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v2 |
| ef:activity/change/20260820T1555490862250000/25304 | synonyms | ef:agent/bootstrap_labels | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v2 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v3 |
| ef:activity/change/20260820T1555490862250000/184652 | context | ef:agent/default_context_mapping | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v3 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v4 |
| ef:activity/change/20260820T1555490862250000/184653 | context_iri | ef:agent/default_context_mapping | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v4 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v5 |
| ef:activity/change/20260820T1555490862250000/213762 | unit_iri | ef:agent/unit_normalization | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v5 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v6 |
| ef:activity/change/20260820T1555490862250000/221389 | prefLabel | ef:agent/normalize_name_case | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v6 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v7 |
| ef:activity/change/20260820T1555490862250000/228396 | properties | ef:agent/enrich_references | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v7 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v8 |
| ef:activity/change/20260820T1555490862250000/228397 | skos_definition | ef:agent/enrich_references | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v8 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v9 |
| ef:activity/change/20260820T1555490862250000/228398 | references | ef:agent/enrich_references | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v9 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v10 |
| ef:activity/change/20260820T1555490862250000/248673 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v10 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v11 |
| ef:activity/change/20260820T1555490862250000/268125 | altLabel | ef:agent/consensus_match | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v11 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v12 |
| ef:activity/change/20260820T1555490862250000/268126 | cas_match_labels | ef:agent/consensus_match | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v12 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v13 |
| ef:activity/change/20260820T1555490862250000/273810 | properties | ef:agent/opsin_iupac | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v13 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v14 |
| ef:activity/change/20260820T1555490862250000/280192 | properties | ef:agent/rdkit_post_consensus | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v14 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v15 |
| ef:activity/change/20260820T1555490862250000/287534 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v15 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v16 |
| ef:activity/change/20260820T1555490862250000/373375 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v16 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v17 |
| ef:activity/change/20260820T1555490862250000/388093 | properties | ef:agent/normalise_property_values | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v17 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v18 |
| ef:activity/change/20260820T1555490862250000/394690 | types | ef:agent/link_flows_to_their_substance | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v18 | ef:flow/e28a55fd-333b-4fb0-b9b4-fd90cc627b27/v19 |