Oxepan-2-one
Everything that changed this flow. Back to the flow
ad12c34f-965a-4a82-9283-4ee20666e8b6
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus | typed the way the ontology types it |
| altLabel | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'C 0702' (grade 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=oxepan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'502-44-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-65a66255ca9db827: {'502-44-3': '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 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=['502-44-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_17915']; candidate_pubchem_cids=[10401]; selected_pubchem_cids=[10401]; 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 |
|---|---|---|---|---|---|
| 2,788 | bootstrap_labels | prefLabel | — | [{"@value":"oxepan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | Bootstrapped prefLabel from legacy name field |
| 2,789 | bootstrap_labels | name | oxepan-2-one | — | Purged legacy name field to enforce prefLabel usage |
| 2,790 | bootstrap_labels | synonyms | ["organic","hexan-6-olide","placcelm"] | [] | Removed legacy synonyms field in favor of structured labels |
| 152,806 | 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 |
| 152,807 | 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 |
| 214,269 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,728 | normalize_name_case | prefLabel | [{"@value":"oxepan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | [{"@value":"Oxepan-2-one","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":"c… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 229,860 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 229,861 | enrich_references | skos_definition | — | [{"@value":"A ε-lactone that is oxepane substituted by an oxo group at position 2.","@language":"en","provenance":{"pro… | Merged ChEBI/PubChem definitions into skos:definition |
| 229,862 | enrich_references | references | [] | [{"@id":"gmelin:675457","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"con… | Added references with provenance; cas_numbers=['502-44-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_17915']; candidate_pubchem_cids=[10401]; selected_pubchem_cids=[10401]; 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 |
| 254,695 | chebi_altlabels | altLabel | [] | [{"@value":"1,6-hexanolide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | Added 15 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 270,215 | consensus_match | altLabel | [{"@value":"1,6-hexanolide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | [{"@value":"1,6-hexanolide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | group_key=oxepan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; cas=502-44-3; added Common Chemistry CAS names as altLabel: 2-Oxooxopane, C 0702, Caprolactone A, Hexamethylene oxide, 2-oxo-, Hexanoic acid, 6-hydroxy-, lactone, Hexanoic acid, 6-hydroxy-, ε-lactone, Nyrim 1 Additive 6, Placcel M, Tone ECEQ, Tone Monomer EC, ε-Caprolactone, ε-Hexanolactone; object_uuid=fo-65a66255ca9db827 |
| 270,216 | consensus_match | cas_match_labels | — | {"502-44-3":"exactMatch"} | group_key=oxepan-2-one||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'502-44-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-65a66255ca9db827: {'502-44-3': 'exactMatch'} |
| 274,210 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Oxepan-2-one' |
| 280,632 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | rdkit_post_consensus from 'O=C1CCCCCO1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,805 | strip_catalogue_altlabels | altLabel | [{"@value":"1,6-hexanolide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | [{"@value":"1,6-hexanolide","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttributedTo":"… | Removed 1 catalogue altLabel value(s): 'C 0702' (grade code) |
| 357,426 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/ad12c34f-965a-… | associations resolved on the elementary layer |
| 388,501 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10O2"],… | typed the way the ontology types it |
| 395,261 | 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/20260822T0600486828500000/2788 | prefLabel | ef:agent/bootstrap_labels | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v0 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v1 |
| ef:activity/change/20260822T0600486828500000/2789 | name | ef:agent/bootstrap_labels | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v1 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v2 |
| ef:activity/change/20260822T0600486828500000/2790 | synonyms | ef:agent/bootstrap_labels | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v2 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v3 |
| ef:activity/change/20260822T0600486828500000/152806 | context | ef:agent/default_context_mapping | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v3 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v4 |
| ef:activity/change/20260822T0600486828500000/152807 | context_iri | ef:agent/default_context_mapping | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v4 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v5 |
| ef:activity/change/20260822T0600486828500000/214269 | unit_iri | ef:agent/unit_normalization | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v5 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v6 |
| ef:activity/change/20260822T0600486828500000/221728 | prefLabel | ef:agent/normalize_name_case | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v6 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v7 |
| ef:activity/change/20260822T0600486828500000/229860 | properties | ef:agent/enrich_references | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v7 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v8 |
| ef:activity/change/20260822T0600486828500000/229861 | skos_definition | ef:agent/enrich_references | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v8 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v9 |
| ef:activity/change/20260822T0600486828500000/229862 | references | ef:agent/enrich_references | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v9 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v10 |
| ef:activity/change/20260822T0600486828500000/254695 | altLabel | ef:agent/chebi_altlabels | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v10 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v11 |
| ef:activity/change/20260822T0600486828500000/270215 | altLabel | ef:agent/consensus_match | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v11 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v12 |
| ef:activity/change/20260822T0600486828500000/270216 | cas_match_labels | ef:agent/consensus_match | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v12 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v13 |
| ef:activity/change/20260822T0600486828500000/274210 | properties | ef:agent/opsin_iupac | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v13 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v14 |
| ef:activity/change/20260822T0600486828500000/280632 | properties | ef:agent/rdkit_post_consensus | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v14 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v15 |
| ef:activity/change/20260822T0600486828500000/287805 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v15 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v16 |
| ef:activity/change/20260822T0600486828500000/357426 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v16 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v17 |
| ef:activity/change/20260822T0600486828500000/388501 | properties | ef:agent/normalise_property_values | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v17 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v18 |
| ef:activity/change/20260822T0600486828500000/395261 | types | ef:agent/link_flows_to_their_substance | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v18 | ef:flow/ad12c34f-965a-4a82-9283-4ee20666e8b6/v19 |