(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione
Everything that changed this flow. Back to the flow
022de546-cd5c-4526-ac6b-56cf2013b170
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, link_flows_to_their_substance, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | the substance's answer, copied onto its flow |
| altLabel | 2 | consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'13076-17-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f2ed410f1796bb0: {'13076-17-0': '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 urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 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=['13076-17-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[7272, 107983, 5325924]; selected_pubchem_cids=[5325924]; 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 |
|---|---|---|---|---|---|
| 1,808 | bootstrap_labels | prefLabel | — | [{"@value":"(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_lab… | Bootstrapped prefLabel from legacy name field |
| 1,809 | bootstrap_labels | name | (3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione | — | Purged legacy name field to enforce prefLabel usage |
| 1,810 | bootstrap_labels | synonyms | ["organic","1,4-dioxane-2,5-dione,3,6-dimethyl-,(3r,6r)-"] | [] | Removed legacy synonyms field in favor of structured labels |
| 27,168 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 27,169 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 213,947 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 228,927 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,928 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,929 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J231.860A","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['13076-17-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[7272, 107983, 5325924]; selected_pubchem_cids=[5325924]; 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 |
| 248,825 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | rdkit_pre_consensus from 'CC1C(=O)OC(C(=O)O1)C'; added: inchi2d_string, molecular_mass, monoisotopic_mass |
| 257,739 | consensus_match | altLabel | [] | [{"@value":"(R,R)-3,6-Di-methyl-1,4-dioxane-2,5-dione","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | group_key=(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=13076-17-0; added Common Chemistry CAS names as altLabel: (R,R)-3,6-Di-methyl-1,4-dioxane-2,5-dione, 1,4-Dioxane-2,5-dione, 3,6-dimethyl-, (3<em>R</em>,5<em>R</em>)-, 1,4-Dioxane-2,5-dione, 3,6-dimethyl-, (3<em>R</em>,6<em>R</em>)-, 1,4-Dioxane-2,5-dione, 3,6-dimethyl-, (3<em>R</em>-<em>cis</em>)-, <em>p</em>-Dioxane-2,5-dione, 3,6-dimethyl-, <span class="text-smallcaps">D</span>-, <span class="text-smallcaps">D</smallcap>,<smallcap>D</span>-Dilactide, <span class="text-smallcaps">D</smallcap><smallcap>D</span>-lactide, <span class="text-smallcaps">D</span>-(+)-Lactide, <span class="text-smallcaps">D</span>-Dilactide, <span class="text-smallcaps">D</span>-Lactide, PuraLact D, Purasorb D; object_uuid=fo-5f2ed410f1796bb0 |
| 257,740 | consensus_match | cas_match_labels | — | {"13076-17-0":"exactMatch"} | group_key=(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'13076-17-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f2ed410f1796bb0: {'13076-17-0': 'exactMatch'} |
| 273,960 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(3r,6r)-3,6-dimethyl-1,4-dioxane-2,5-dione' |
| 280,357 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | rdkit_post_consensus from 'C[C@H]1OC(=O)[C@@H](C)OC1=O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,079 | dedupe_altlabels | altLabel | [{"@value":"(R,R)-3,6-Di-methyl-1,4-dioxane-2,5-dione","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | [{"@value":"(R,R)-3,6-Di-methyl-1,4-dioxane-2,5-dione","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | Deduplicated altLabel values and removed entries matching prefLabel |
| 294,648 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/022de546-cd5c-… | associations resolved on the elementary layer |
| 388,251 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | typed the way the ontology types it |
| 394,896 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
| 394,897 | link_flows_to_their_substance | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H8O4"],"… | 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/20260820T0738569779880000/1808 | prefLabel | ef:agent/bootstrap_labels | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v0 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v1 |
| ef:activity/change/20260820T0738569779880000/1809 | name | ef:agent/bootstrap_labels | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v1 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v2 |
| ef:activity/change/20260820T0738569779880000/1810 | synonyms | ef:agent/bootstrap_labels | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v2 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v3 |
| ef:activity/change/20260820T0738569779880000/27168 | context | ef:agent/default_context_mapping | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v3 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v4 |
| ef:activity/change/20260820T0738569779880000/27169 | context_iri | ef:agent/default_context_mapping | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v4 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v5 |
| ef:activity/change/20260820T0738569779880000/213947 | unit_iri | ef:agent/unit_normalization | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v5 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v6 |
| ef:activity/change/20260820T0738569779880000/228927 | properties | ef:agent/enrich_references | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v6 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v7 |
| ef:activity/change/20260820T0738569779880000/228928 | skos_definition | ef:agent/enrich_references | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v7 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v8 |
| ef:activity/change/20260820T0738569779880000/228929 | references | ef:agent/enrich_references | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v8 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v9 |
| ef:activity/change/20260820T0738569779880000/248825 | properties | ef:agent/rdkit_pre_consensus | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v9 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v10 |
| ef:activity/change/20260820T0738569779880000/257739 | altLabel | ef:agent/consensus_match | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v10 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v11 |
| ef:activity/change/20260820T0738569779880000/257740 | cas_match_labels | ef:agent/consensus_match | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v11 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v12 |
| ef:activity/change/20260820T0738569779880000/273960 | properties | ef:agent/opsin_iupac | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v12 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v13 |
| ef:activity/change/20260820T0738569779880000/280357 | properties | ef:agent/rdkit_post_consensus | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v13 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v14 |
| ef:activity/change/20260820T0738569779880000/292079 | altLabel | ef:agent/dedupe_altlabels | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v14 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v15 |
| ef:activity/change/20260820T0738569779880000/294648 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v15 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v16 |
| ef:activity/change/20260820T0738569779880000/388251 | properties | ef:agent/normalise_property_values | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v16 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v17 |
| ef:activity/change/20260820T0738569779880000/394896 | types | ef:agent/link_flows_to_their_substance | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v17 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v18 |
| ef:activity/change/20260820T0738569779880000/394897 | properties | ef:agent/link_flows_to_their_substance | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v18 | ef:flow/022de546-cd5c-4526-ac6b-56cf2013b170/v19 |