4-methyl-1,3-oxazole-5-carbonitrile
Everything that changed this flow. Back to the flow
2b8f1e37-dd11-462b-9ed4-a7a9d2542a97
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 | 1 | consensus_match | group_key=4-methyl-1,3-oxazole-5-carbonitrile||dimension=Environmental > media=Water > water_body=Surface water; cas=1003-52-7; added Common Chemistry CAS names as altLabel: 4-Methyl-5-cyanooxazole, 4-Methyl-5-oxazolecarbonitrile, 5-Cyano-4-methyloxazole, 5-Oxazolecarbonitrile, 4-methyl-; object_uuid=fo-352a40c4b54ef928 |
| cas_match_labels | 1 | consensus_match | group_key=4-methyl-1,3-oxazole-5-carbonitrile||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1003-52-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-352a40c4b54ef928: {'1003-52-7': '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 air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 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=['1003-52-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[70480, 294136]; selected_pubchem_cids=[70480]; 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 |
|---|---|---|---|---|---|
| 161 | bootstrap_labels | prefLabel | — | [{"@value":"4-methyl-1,3-oxazole-5-carbonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 162 | bootstrap_labels | name | 4-methyl-1,3-oxazole-5-carbonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 163 | bootstrap_labels | synonyms | ["organic","4-methyloxazole-5-carbonitrile"] | [] | Removed legacy synonyms field in favor of structured labels |
| 65,874 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 65,875 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 213,392 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 227,321 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,322 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,323 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J217.110D","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['1003-52-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[70480, 294136]; selected_pubchem_cids=[70480]; 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 |
| 248,355 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | rdkit_pre_consensus from 'CC1=C(OC=N1)C#N'; added: molecular_mass, monoisotopic_mass |
| 262,813 | consensus_match | altLabel | [] | [{"@value":"4-Methyl-5-cyanooxazole","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | group_key=4-methyl-1,3-oxazole-5-carbonitrile||dimension=Environmental > media=Water > water_body=Surface water; cas=1003-52-7; added Common Chemistry CAS names as altLabel: 4-Methyl-5-cyanooxazole, 4-Methyl-5-oxazolecarbonitrile, 5-Cyano-4-methyloxazole, 5-Oxazolecarbonitrile, 4-methyl-; object_uuid=fo-352a40c4b54ef928 |
| 262,814 | consensus_match | cas_match_labels | — | {"1003-52-7":"exactMatch"} | group_key=4-methyl-1,3-oxazole-5-carbonitrile||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1003-52-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-352a40c4b54ef928: {'1003-52-7': 'exactMatch'} |
| 273,499 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-methyl-1,3-oxazole-5-carbonitrile' |
| 279,850 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | rdkit_post_consensus from 'Cc1ncoc1C#N'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 313,974 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/2b8f1e37-dd11-… | associations resolved on the elementary layer |
| 387,777 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C5H4N2O"],… | typed the way the ontology types it |
| 394,248 | 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/20260820T0738569779880000/161 | prefLabel | ef:agent/bootstrap_labels | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v0 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v1 |
| ef:activity/change/20260820T0738569779880000/162 | name | ef:agent/bootstrap_labels | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v1 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v2 |
| ef:activity/change/20260820T0738569779880000/163 | synonyms | ef:agent/bootstrap_labels | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v2 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v3 |
| ef:activity/change/20260820T0738569779880000/65874 | context | ef:agent/default_context_mapping | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v3 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v4 |
| ef:activity/change/20260820T0738569779880000/65875 | context_iri | ef:agent/default_context_mapping | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v4 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v5 |
| ef:activity/change/20260820T0738569779880000/213392 | unit_iri | ef:agent/unit_normalization | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v5 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v6 |
| ef:activity/change/20260820T0738569779880000/227321 | properties | ef:agent/enrich_references | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v6 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v7 |
| ef:activity/change/20260820T0738569779880000/227322 | skos_definition | ef:agent/enrich_references | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v7 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v8 |
| ef:activity/change/20260820T0738569779880000/227323 | references | ef:agent/enrich_references | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v8 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v9 |
| ef:activity/change/20260820T0738569779880000/248355 | properties | ef:agent/rdkit_pre_consensus | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v9 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v10 |
| ef:activity/change/20260820T0738569779880000/262813 | altLabel | ef:agent/consensus_match | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v10 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v11 |
| ef:activity/change/20260820T0738569779880000/262814 | cas_match_labels | ef:agent/consensus_match | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v11 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v12 |
| ef:activity/change/20260820T0738569779880000/273499 | properties | ef:agent/opsin_iupac | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v12 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v13 |
| ef:activity/change/20260820T0738569779880000/279850 | properties | ef:agent/rdkit_post_consensus | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v13 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v14 |
| ef:activity/change/20260820T0738569779880000/313974 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v14 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v15 |
| ef:activity/change/20260820T0738569779880000/387777 | properties | ef:agent/normalise_property_values | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v15 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v16 |
| ef:activity/change/20260820T0738569779880000/394248 | types | ef:agent/link_flows_to_their_substance | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v16 | ef:flow/2b8f1e37-dd11-462b-9ed4-a7a9d2542a97/v17 |