Dodecanedioic Acid
Everything that changed this flow. Back to the flow
244130f8-0e6d-4bb3-a8d3-cbaaab18ec90
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, strip_catalogue_altlabels | Removed 3 catalogue altLabel value(s): 'DC 12S' (grade code), 'LCA 141' (grade code), 'NSC 400242' (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=dodecanedioicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'693-23-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c2fee99f72f59025: {'693-23-2': '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 soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['693-23-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_4676']; candidate_pubchem_cids=[12736, 161595, 6991984]; selected_pubchem_cids=[12736]; 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 |
|---|---|---|---|---|---|
| 5,496 | bootstrap_labels | prefLabel | — | [{"@value":"dodecanedioic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 5,497 | bootstrap_labels | name | dodecanedioic acid | — | Purged legacy name field to enforce prefLabel usage |
| 5,498 | bootstrap_labels | synonyms | ["organic","dodecanedioicacid","dc12","dc12d","dc12gn","dc12p","dc12s","dc12sb","dc12sc","ddda","dds"] | [] | Removed legacy synonyms field in favor of structured labels |
| 60,700 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 60,701 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 215,174 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,368 | normalize_name_case | prefLabel | [{"@value":"dodecanedioic acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | [{"@value":"Dodecanedioic Acid","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 232,463 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,464 | enrich_references | skos_definition | — | [{"@value":"An α,ω-dicarboxylic acid that is dodecane in which the methyl groups have been oxidised to the correspondin… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,465 | enrich_references | references | [] | [{"@id":"agr:IND44425877","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"c… | Added references with provenance; cas_numbers=['693-23-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_4676']; candidate_pubchem_cids=[12736, 161595, 6991984]; selected_pubchem_cids=[12736]; 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 |
| 249,833 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | rdkit_pre_consensus from 'C(CCCCCC(=O)O)CCCCC(=O)O'; added: monoisotopic_mass |
| 255,069 | chebi_altlabels | altLabel | [] | [{"@value":"1,10-decanedicarboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasA… | Added 4 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 266,620 | consensus_match | altLabel | [{"@value":"1,10-decanedicarboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasA… | [{"@value":"1,10-decanedicarboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasA… | group_key=dodecanedioicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=693-23-2; added Common Chemistry CAS names as altLabel: <em>n</em>-Dodecane-α,ω-dioic acid, <em>n</em>-Dodecanedioic acid, Corfree M 2, DC 12S, LCA 141, NSC 400242, SL-AH; object_uuid=fo-c2fee99f72f59025 |
| 266,621 | consensus_match | cas_match_labels | — | {"693-23-2":"exactMatch"} | group_key=dodecanedioicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'693-23-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c2fee99f72f59025: {'693-23-2': 'exactMatch'} |
| 274,972 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Dodecanedioic Acid' |
| 281,456 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | rdkit_post_consensus from 'O=C(O)CCCCCCCCCCC(=O)O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,375 | strip_catalogue_altlabels | altLabel | [{"@value":"1,10-decanedicarboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasA… | [{"@value":"1,10-decanedicarboxylic acid","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasA… | Removed 3 catalogue altLabel value(s): 'DC 12S' (grade code), 'LCA 141' (grade code), 'NSC 400242' (registry code) |
| 311,369 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/244130f8-0e6d-… | associations resolved on the elementary layer |
| 389,281 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H22O4"]… | typed the way the ontology types it |
| 396,360 | 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/20260822T0600486828500000/5496 | prefLabel | ef:agent/bootstrap_labels | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v0 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v1 |
| ef:activity/change/20260822T0600486828500000/5497 | name | ef:agent/bootstrap_labels | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v1 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v2 |
| ef:activity/change/20260822T0600486828500000/5498 | synonyms | ef:agent/bootstrap_labels | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v2 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v3 |
| ef:activity/change/20260822T0600486828500000/60700 | context | ef:agent/default_context_mapping | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v3 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v4 |
| ef:activity/change/20260822T0600486828500000/60701 | context_iri | ef:agent/default_context_mapping | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v4 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v5 |
| ef:activity/change/20260822T0600486828500000/215174 | unit_iri | ef:agent/unit_normalization | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v5 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v6 |
| ef:activity/change/20260822T0600486828500000/222368 | prefLabel | ef:agent/normalize_name_case | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v6 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v7 |
| ef:activity/change/20260822T0600486828500000/232463 | properties | ef:agent/enrich_references | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v7 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v8 |
| ef:activity/change/20260822T0600486828500000/232464 | skos_definition | ef:agent/enrich_references | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v8 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v9 |
| ef:activity/change/20260822T0600486828500000/232465 | references | ef:agent/enrich_references | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v9 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v10 |
| ef:activity/change/20260822T0600486828500000/249833 | properties | ef:agent/rdkit_pre_consensus | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v10 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v11 |
| ef:activity/change/20260822T0600486828500000/255069 | altLabel | ef:agent/chebi_altlabels | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v11 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v12 |
| ef:activity/change/20260822T0600486828500000/266620 | altLabel | ef:agent/consensus_match | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v12 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v13 |
| ef:activity/change/20260822T0600486828500000/266621 | cas_match_labels | ef:agent/consensus_match | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v13 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v14 |
| ef:activity/change/20260822T0600486828500000/274972 | properties | ef:agent/opsin_iupac | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v14 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v15 |
| ef:activity/change/20260822T0600486828500000/281456 | properties | ef:agent/rdkit_post_consensus | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v15 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v16 |
| ef:activity/change/20260822T0600486828500000/288375 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v16 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v17 |
| ef:activity/change/20260822T0600486828500000/311369 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v17 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v18 |
| ef:activity/change/20260822T0600486828500000/389281 | properties | ef:agent/normalise_property_values | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v18 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v19 |
| ef:activity/change/20260822T0600486828500000/396360 | types | ef:agent/link_flows_to_their_substance | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v19 | ef:flow/244130f8-0e6d-4bb3-a8d3-cbaaab18ec90/v20 |