Propanedioic Acid, 1,3-dithiolan-2-ylidene-, Bis
Everything that changed this flow. Back to the flow
248c6ce8-4448-486a-a9a8-bae58c0b3681
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 | 3 | chebi_altlabels, consensus_match, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=propanedioicacid,1,3-dithiolan-2-ylidene-,bis||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi']; cas_sources={'52303-69-2': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-93cc44cacbc2b5b1: {'52303-69-2': '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 soil > Emissions to agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['52303-69-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_6048']; candidate_pubchem_cids=[5783, 93275]; selected_pubchem_cids=[93275]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 10,149 | bootstrap_labels | prefLabel | — | [{"@value":"propanedioic acid, 1,3-dithiolan-2-ylidene-, bis","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Bootstrapped prefLabel from legacy name field |
| 10,150 | bootstrap_labels | name | propanedioic acid, 1,3-dithiolan-2-ylidene-, bis | — | Purged legacy name field to enforce prefLabel usage |
| 10,151 | bootstrap_labels | synonyms | ["2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","AC1L3PVA","AC1Q5XTK","Bis(1-methy… | [] | Removed legacy synonyms field in favor of structured labels |
| 60,876 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 60,877 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 216,709 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,467 | normalize_name_case | prefLabel | [{"@value":"propanedioic acid, 1,3-dithiolan-2-ylidene-, bis","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | [{"@value":"Propanedioic Acid, 1,3-dithiolan-2-ylidene-, Bis","@language":"en","source":{"prov:wasGeneratedBy":"bootstr… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 236,867 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,868 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 236,869 | enrich_references | references | [] | [{"@id":"beilstein:4321780","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['52303-69-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_6048']; candidate_pubchem_cids=[5783, 93275]; selected_pubchem_cids=[93275]; 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 |
| 251,103 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | rdkit_pre_consensus from 'CC(C)OC(=O)C(=C1SCCS1=O)C(=O)OC(C)C'; added: monoisotopic_mass |
| 255,824 | chebi_altlabels | altLabel | [] | [{"@value":"2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","@language":"en","source… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 271,039 | consensus_match | altLabel | [{"@value":"2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","@language":"en","source… | [{"@value":"2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","@language":"en","source… | group_key=propanedioicacid,1,3-dithiolan-2-ylidene-,bis||dimension=Environmental > media=Water > water_body=Long-term; cas=52303-69-2; added Common Chemistry CAS names as altLabel: 1,3-Bis(1-methylethyl) 2-(1-oxido-1,3-dithiolan-2-ylidene)propanedioate, 2-(Diisopropoxycarbonyl)methylidene-1,3-dithiolan-1-oxide, Propanedioic acid, (1-oxido-1,3-dithiolan-2-ylidene)-, bis(1-methylethyl) ester, Propanedioic acid, 1,3-dithiolan-2-ylidene-, bis(1-methylethyl) ester, <em>S</em>-oxide, Propanedioic acid, 2-(1-oxido-1,3-dithiolan-2-ylidene)-, 1,3-bis(1-methylethyl) ester; object_uuid=fo-93cc44cacbc2b5b1 |
| 271,040 | consensus_match | cas_match_labels | — | {"52303-69-2":"exactMatch"} | group_key=propanedioicacid,1,3-dithiolan-2-ylidene-,bis||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi']; cas_sources={'52303-69-2': ['chebi']}; assigned CAS labels from group consensus; object_uuid=fo-93cc44cacbc2b5b1: {'52303-69-2': 'exactMatch'} |
| 276,287 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate' |
| 282,877 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | rdkit_post_consensus from 'CC(C)OC(=O)C(C(=O)OC(C)C)=C1SCC[S+]1[O-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,496 | dedupe_altlabels | altLabel | [{"@value":"2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","@language":"en","source… | [{"@value":"2-[1,3-dioxo-1,3-bis(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-1-ium-1-olate","@language":"en","source… | Deduplicated altLabel values and removed entries matching prefLabel |
| 311,457 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/248c6ce8-4448-… | associations resolved on the elementary layer |
| 390,632 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H18O5S2… | typed the way the ontology types it |
| 398,325 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1554374006150000/10149 | prefLabel | ef:agent/bootstrap_labels | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v0 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v1 |
| ef:activity/change/20260821T1554374006150000/10150 | name | ef:agent/bootstrap_labels | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v1 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v2 |
| ef:activity/change/20260821T1554374006150000/10151 | synonyms | ef:agent/bootstrap_labels | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v2 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v3 |
| ef:activity/change/20260821T1554374006150000/60876 | context | ef:agent/default_context_mapping | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v3 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v4 |
| ef:activity/change/20260821T1554374006150000/60877 | context_iri | ef:agent/default_context_mapping | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v4 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v5 |
| ef:activity/change/20260821T1554374006150000/216709 | unit_iri | ef:agent/unit_normalization | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v5 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v6 |
| ef:activity/change/20260821T1554374006150000/223467 | prefLabel | ef:agent/normalize_name_case | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v6 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v7 |
| ef:activity/change/20260821T1554374006150000/236867 | properties | ef:agent/enrich_references | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v7 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v8 |
| ef:activity/change/20260821T1554374006150000/236868 | skos_definition | ef:agent/enrich_references | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v8 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v9 |
| ef:activity/change/20260821T1554374006150000/236869 | references | ef:agent/enrich_references | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v9 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v10 |
| ef:activity/change/20260821T1554374006150000/251103 | properties | ef:agent/rdkit_pre_consensus | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v10 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v11 |
| ef:activity/change/20260821T1554374006150000/255824 | altLabel | ef:agent/chebi_altlabels | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v11 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v12 |
| ef:activity/change/20260821T1554374006150000/271039 | altLabel | ef:agent/consensus_match | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v12 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v13 |
| ef:activity/change/20260821T1554374006150000/271040 | cas_match_labels | ef:agent/consensus_match | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v13 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v14 |
| ef:activity/change/20260821T1554374006150000/276287 | properties | ef:agent/opsin_iupac | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v14 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v15 |
| ef:activity/change/20260821T1554374006150000/282877 | properties | ef:agent/rdkit_post_consensus | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v15 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v16 |
| ef:activity/change/20260821T1554374006150000/292496 | altLabel | ef:agent/dedupe_altlabels | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v16 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v17 |
| ef:activity/change/20260821T1554374006150000/311457 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v17 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v18 |
| ef:activity/change/20260821T1554374006150000/390632 | properties | ef:agent/normalise_property_values | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v18 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v19 |
| ef:activity/change/20260821T1554374006150000/398325 | types | ef:agent/link_flows_to_their_substance | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v19 | ef:flow/248c6ce8-4448-486a-a9a8-bae58c0b3681/v20 |