5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol
Everything that changed this flow. Back to the flow
fe0acd60-3ddc-11dd-9e84-0050c2490048
By field
12 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 |
| cas_match_labels | 1 | consensus_match | group_key=5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'2122-86-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eafccb4323476040: {'2122-86-3': '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 water, unspecified (long-term) |
| 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 (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=['2122-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[16463]; selected_pubchem_cids=[16463]; 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
16| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 17,766 | bootstrap_labels | prefLabel | — | [{"@value":"5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labe… | Bootstrapped prefLabel from legacy name field |
| 17,767 | bootstrap_labels | name | 5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol | — | Purged legacy name field to enforce prefLabel usage |
| 17,768 | bootstrap_labels | synonyms | [".DELTA.2-1,3,4-Oxadiazolin-5-one, 2-(5-nitro-2-furyl)-","1,3,4-OXADIAZOLE-2-OL, 5-(5-NITRO-2-FURYL)-","1,3,4-Oxadiazo… | [] | Removed legacy synonyms field in favor of structured labels |
| 202,496 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 202,497 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 219,157 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 243,820 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,821 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,822 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.621G","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['2122-86-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[16463]; selected_pubchem_cids=[16463]; 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 |
| 253,111 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | rdkit_pre_consensus from 'C1=C(OC(=C1)[N+](=O)[O-])C2=NNC(=O)O2'; added: molecular_mass, monoisotopic_mass |
| 263,000 | consensus_match | cas_match_labels | — | {"2122-86-3":"exactMatch"} | group_key=5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'2122-86-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-eafccb4323476040: {'2122-86-3': 'exactMatch'} |
| 278,314 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '5-(5-nitro-2-furyl)-1,3,4-oxadiazole-2-ol' |
| 285,067 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | rdkit_post_consensus from 'O=[N+]([O-])c1ccc(-c2nnc(O)o2)o1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 382,282 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fe0acd60-3ddc-… | associations resolved on the elementary layer |
| 392,674 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H3N3O5"]… | typed the way the ontology types it |
| 401,263 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
16 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/20260821T1554374006150000/17766 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v0 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/17767 | name | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v1 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/17768 | synonyms | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v2 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/202496 | context | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v3 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/202497 | context_iri | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v4 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/219157 | unit_iri | ef:agent/unit_normalization | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v5 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/243820 | properties | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v6 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/243821 | skos_definition | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v7 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/243822 | references | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v8 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/253111 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v9 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/263000 | cas_match_labels | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v10 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/278314 | properties | ef:agent/opsin_iupac | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v11 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/285067 | properties | ef:agent/rdkit_post_consensus | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v12 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/382282 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v13 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/392674 | properties | ef:agent/normalise_property_values | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v14 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/401263 | types | ef:agent/link_flows_to_their_substance | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v15 | ef:flow/fe0acd60-3ddc-11dd-9e84-0050c2490048/v16 |