Acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone
Everything that changed this flow. Back to the flow
08a91e70-3ddc-11dd-9930-0050c2490048
By field
12 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 |
| 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=acetone[4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=[]; cas_sources={'18523-69-8': []}; assigned CAS labels from group consensus; object_uuid=fo-02177f2edc95af35: {'18523-69-8': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['18523-69-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[29118, 4415524]; selected_pubchem_cids=[29118, 4415524]; 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 |
|---|---|---|---|---|---|
| 8,083 | bootstrap_labels | prefLabel | — | [{"@value":"acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone","@language":"en","source":{"prov:wasGeneratedBy":"boots… | Bootstrapped prefLabel from legacy name field |
| 8,084 | bootstrap_labels | name | acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone | — | Purged legacy name field to enforce prefLabel usage |
| 8,085 | bootstrap_labels | synonyms | ["(4-(5-Nitro-2-furyl)thiazol-2-yl)hydrazonoacetone","2-(2-Isopropylidenehydrazono)-4-(5-nitro-2-furyl)-thiazole","4-(5… | [] | Removed legacy synonyms field in favor of structured labels |
| 36,582 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 36,583 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 216,035 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,001 | normalize_name_case | prefLabel | [{"@value":"acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone","@language":"en","source":{"prov:wasGeneratedBy":"boots… | [{"@value":"Acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone","@language":"en","source":{"prov:wasGeneratedBy":"boots… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 234,910 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 234,911 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 234,912 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J33.804D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['18523-69-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[29118, 4415524]; selected_pubchem_cids=[29118, 4415524]; 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 |
| 250,534 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | rdkit_pre_consensus from 'CC(=NNC1=NC(=CS1)C2=CC=C(O2)[N+](=O)[O-])C'; added: molecular_mass, monoisotopic_mass |
| 263,516 | consensus_match | cas_match_labels | — | {"18523-69-8":"exactMatch"} | group_key=acetone[4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=[]; cas_sources={'18523-69-8': []}; assigned CAS labels from group consensus; object_uuid=fo-02177f2edc95af35: {'18523-69-8': 'exactMatch'} |
| 275,698 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Acetone [4-(5-nitro-2-furyl)-2-thiazolyl]hydrazone' |
| 282,249 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | rdkit_post_consensus from 'CC(C)=NNc1nc(-c2ccc([N+](=O)[O-])o2)cs1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 286,889 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H10N4O3… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 299,317 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/08a91e70-3ddc-… | associations resolved on the elementary layer |
| 397,483 | 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/20260821T1302361922970000/8083 | prefLabel | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v0 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v1 |
| ef:activity/change/20260821T1302361922970000/8084 | name | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v1 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v2 |
| ef:activity/change/20260821T1302361922970000/8085 | synonyms | ef:agent/bootstrap_labels | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v2 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v3 |
| ef:activity/change/20260821T1302361922970000/36582 | context | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v3 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v4 |
| ef:activity/change/20260821T1302361922970000/36583 | context_iri | ef:agent/default_context_mapping | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v4 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v5 |
| ef:activity/change/20260821T1302361922970000/216035 | unit_iri | ef:agent/unit_normalization | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v5 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v6 |
| ef:activity/change/20260821T1302361922970000/223001 | prefLabel | ef:agent/normalize_name_case | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v6 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v7 |
| ef:activity/change/20260821T1302361922970000/234910 | properties | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v7 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v8 |
| ef:activity/change/20260821T1302361922970000/234911 | skos_definition | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v8 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v9 |
| ef:activity/change/20260821T1302361922970000/234912 | references | ef:agent/enrich_references | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v9 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v10 |
| ef:activity/change/20260821T1302361922970000/250534 | properties | ef:agent/rdkit_pre_consensus | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v10 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v11 |
| ef:activity/change/20260821T1302361922970000/263516 | cas_match_labels | ef:agent/consensus_match | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v11 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v12 |
| ef:activity/change/20260821T1302361922970000/275698 | properties | ef:agent/opsin_iupac | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v12 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v13 |
| ef:activity/change/20260821T1302361922970000/282249 | properties | ef:agent/rdkit_post_consensus | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v13 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v14 |
| ef:activity/change/20260821T1302361922970000/286889 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v14 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v15 |
| ef:activity/change/20260821T1302361922970000/299317 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v15 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v16 |
| ef:activity/change/20260821T1302361922970000/397483 | types | ef:agent/link_flows_to_their_substance | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v16 | ef:flow/08a91e70-3ddc-11dd-9930-0050c2490048/v17 |