Ethane-1,2-diyl Bis(3-oxobutanoate)
Everything that changed this flow. Back to the flow
c50b89b8-c268-4c5c-961b-beefa0c39011
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 2 catalogue altLabel value(s): 'AAEG 215' (grade code), 'NSC 24317' (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=ethane-1,2-diylbis(3-oxobutanoate)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5459-04-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f900cf67c844092: {'5459-04-1': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['5459-04-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[79321, 79566]; selected_pubchem_cids=[79566]; 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 |
|---|---|---|---|---|---|
| 18,266 | bootstrap_labels | prefLabel | — | [{"@value":"ethane-1,2-diyl bis(3-oxobutanoate)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 18,267 | bootstrap_labels | name | ethane-1,2-diyl bis(3-oxobutanoate) | — | Purged legacy name field to enforce prefLabel usage |
| 18,268 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 166,488 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 166,489 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 219,314 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,259 | normalize_name_case | prefLabel | [{"@value":"ethane-1,2-diyl bis(3-oxobutanoate)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | [{"@value":"Ethane-1,2-diyl Bis(3-oxobutanoate)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 244,269 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 244,270 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 244,271 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J210.517I","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['5459-04-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[79321, 79566]; selected_pubchem_cids=[79566]; 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 |
| 253,241 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | rdkit_pre_consensus from 'CC(=O)CC(=O)OCCOC(=O)CC(=O)C'; added: molecular_mass, monoisotopic_mass |
| 266,744 | consensus_match | altLabel | [] | [{"@value":"AAEG 215","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consen… | group_key=ethane-1,2-diylbis(3-oxobutanoate)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=5459-04-1; added Common Chemistry CAS names as altLabel: AAEG 215, Acetoacetic acid, ethylene ester, Butanoic acid, 3-oxo-, 1,1′-(1,2-ethanediyl) ester, Ethylene Glycol Bisacetoacetate, Ethylene bis(acetoacetate), Ethylene glycol diacetoacetate, NSC 24317; object_uuid=fo-5f900cf67c844092 |
| 266,745 | consensus_match | cas_match_labels | — | {"5459-04-1":"exactMatch"} | group_key=ethane-1,2-diylbis(3-oxobutanoate)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5459-04-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f900cf67c844092: {'5459-04-1': 'exactMatch'} |
| 278,450 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Ethane-1,2-diyl Bis(3-oxobutanoate)' |
| 285,214 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | rdkit_post_consensus from 'CC(=O)CC(=O)OCCOC(=O)CC(C)=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,936 | strip_catalogue_altlabels | altLabel | [{"@value":"AAEG 215","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consen… | [{"@value":"Acetoacetic acid, ethylene ester","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | Removed 2 catalogue altLabel value(s): 'AAEG 215' (grade code), 'NSC 24317' (registry code) |
| 364,270 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c50b89b8-c268-… | associations resolved on the elementary layer |
| 392,818 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O6"]… | typed the way the ontology types it |
| 401,465 | 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/20260822T0600486828500000/18266 | prefLabel | ef:agent/bootstrap_labels | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v0 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v1 |
| ef:activity/change/20260822T0600486828500000/18267 | name | ef:agent/bootstrap_labels | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v1 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v2 |
| ef:activity/change/20260822T0600486828500000/18268 | synonyms | ef:agent/bootstrap_labels | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v2 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v3 |
| ef:activity/change/20260822T0600486828500000/166488 | context | ef:agent/default_context_mapping | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v3 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v4 |
| ef:activity/change/20260822T0600486828500000/166489 | context_iri | ef:agent/default_context_mapping | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v4 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v5 |
| ef:activity/change/20260822T0600486828500000/219314 | unit_iri | ef:agent/unit_normalization | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v5 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v6 |
| ef:activity/change/20260822T0600486828500000/225259 | prefLabel | ef:agent/normalize_name_case | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v6 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v7 |
| ef:activity/change/20260822T0600486828500000/244269 | properties | ef:agent/enrich_references | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v7 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v8 |
| ef:activity/change/20260822T0600486828500000/244270 | skos_definition | ef:agent/enrich_references | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v8 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v9 |
| ef:activity/change/20260822T0600486828500000/244271 | references | ef:agent/enrich_references | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v9 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v10 |
| ef:activity/change/20260822T0600486828500000/253241 | properties | ef:agent/rdkit_pre_consensus | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v10 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v11 |
| ef:activity/change/20260822T0600486828500000/266744 | altLabel | ef:agent/consensus_match | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v11 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v12 |
| ef:activity/change/20260822T0600486828500000/266745 | cas_match_labels | ef:agent/consensus_match | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v12 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v13 |
| ef:activity/change/20260822T0600486828500000/278450 | properties | ef:agent/opsin_iupac | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v13 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v14 |
| ef:activity/change/20260822T0600486828500000/285214 | properties | ef:agent/rdkit_post_consensus | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v14 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v15 |
| ef:activity/change/20260822T0600486828500000/290936 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v15 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v16 |
| ef:activity/change/20260822T0600486828500000/364270 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v16 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v17 |
| ef:activity/change/20260822T0600486828500000/392818 | properties | ef:agent/normalise_property_values | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v17 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v18 |
| ef:activity/change/20260822T0600486828500000/401465 | types | ef:agent/link_flows_to_their_substance | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v18 | ef:flow/c50b89b8-c268-4c5c-961b-beefa0c39011/v19 |