Tetraethylene glycol
Everything that changed this flow. Back to the flow
4863bd5f-d194-498e-a832-5b419aeddda6
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 | 4 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 2 catalogue altLabel value(s): 'NSC 1262' (registry code), 'PEG-4' (grade code) |
| prefLabel | 2 | bootstrap_labels, consensus_match | cas=112-60-7; cc_chebi_agreed_name='Tetraethylene glycol'; object_uuid=fo-e221f990ecc2e4f9 |
| cas_match_labels | 1 | consensus_match | group_key=3,6,9-trioxaundecane-1,11-diol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'112-60-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e221f990ecc2e4f9: {'112-60-7': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['112-60-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_44920']; candidate_pubchem_cids=[8200]; selected_pubchem_cids=[8200]; 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
21| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 5,549 | bootstrap_labels | prefLabel | — | [{"@value":"3,6,9-trioxaundecane-1,11-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 5,550 | bootstrap_labels | name | 3,6,9-trioxaundecane-1,11-diol | — | Purged legacy name field to enforce prefLabel usage |
| 5,551 | bootstrap_labels | synonyms | ["2,2'-(oxybis(ethyleneoxy)) diethanol","2,2'-[oxybis(2,1-ethanediyloxy)]bisethanol","2,2'-[oxybis(2,1-ethanediyloxy)]d… | [] | Removed legacy synonyms field in favor of structured labels |
| 84,296 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 84,297 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 215,192 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,516 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,517 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,518 | enrich_references | references | [] | [{"@id":"beilstein:1634320","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":… | Added references with provenance; cas_numbers=['112-60-7']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_44920']; candidate_pubchem_cids=[8200]; selected_pubchem_cids=[8200]; 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 |
| 249,850 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | rdkit_pre_consensus from 'C(COCCOCCOCCO)O'; added: monoisotopic_mass |
| 255,075 | chebi_altlabels | altLabel | [] | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | Added 7 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 261,632 | consensus_match | prefLabel | [{"@value":"3,6,9-trioxaundecane-1,11-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | [{"@value":"Tetraethylene glycol","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribute… | cas=112-60-7; cc_chebi_agreed_name='Tetraethylene glycol'; object_uuid=fo-e221f990ecc2e4f9 |
| 261,633 | consensus_match | altLabel | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | cas=112-60-7; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-e221f990ecc2e4f9 |
| 261,634 | consensus_match | altLabel | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | group_key=3,6,9-trioxaundecane-1,11-diol||dimension=Environmental > media=Water > water_body=Unknown; cas=112-60-7; added Common Chemistry CAS names as altLabel: 1,11-Dihydroxy-3,6,9-trioxaundecane, 2,2′-((Oxybis(ethane-2,1-diyl))bis(oxy))bis(ethanol), 2,2′-((Oxybis(ethane-2,1-diyl))bis(oxy))diethanol, 2,2′-[Oxybis(2,1-ethanediyloxy)]bis[ethanol], 2,2′-[Oxybis(2,1-ethanediyloxy)]diethanol, 2,2′-[[Oxybis(ethane-2,1-diyl)]bis(oxy)]bis(ethan-1-ol), 2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethan-1-ol, 2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethanol, Bis[2-(2-hydroxyethoxy)ethyl] ether, Ethanol, 2,2′-[oxybis(2,1-ethanediyloxy)]bis-, Hi-Dry, NSC 1262, TEG; object_uuid=fo-e221f990ecc2e4f9 |
| 261,635 | consensus_match | cas_match_labels | — | {"112-60-7":"exactMatch"} | group_key=3,6,9-trioxaundecane-1,11-diol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'112-60-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e221f990ecc2e4f9: {'112-60-7': 'exactMatch'} |
| 274,989 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tetraethylene glycol' |
| 281,473 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | rdkit_post_consensus from 'OCCOCCOCCOCCO'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,384 | strip_catalogue_altlabels | altLabel | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | [{"@value":"2,2'-[Oxybis(2,1-ethanediyloxy)]diethanol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabel… | Removed 2 catalogue altLabel value(s): 'NSC 1262' (registry code), 'PEG-4' (grade code) |
| 323,162 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4863bd5f-d194-… | associations resolved on the elementary layer |
| 389,297 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H18O5"],… | typed the way the ontology types it |
| 396,382 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
21 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/20260821T1302361922970000/5549 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v0 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v1 |
| ef:activity/change/20260821T1302361922970000/5550 | name | ef:agent/bootstrap_labels | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v1 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v2 |
| ef:activity/change/20260821T1302361922970000/5551 | synonyms | ef:agent/bootstrap_labels | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v2 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v3 |
| ef:activity/change/20260821T1302361922970000/84296 | context | ef:agent/default_context_mapping | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v3 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v4 |
| ef:activity/change/20260821T1302361922970000/84297 | context_iri | ef:agent/default_context_mapping | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v4 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v5 |
| ef:activity/change/20260821T1302361922970000/215192 | unit_iri | ef:agent/unit_normalization | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v5 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v6 |
| ef:activity/change/20260821T1302361922970000/232516 | properties | ef:agent/enrich_references | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v6 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v7 |
| ef:activity/change/20260821T1302361922970000/232517 | skos_definition | ef:agent/enrich_references | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v7 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v8 |
| ef:activity/change/20260821T1302361922970000/232518 | references | ef:agent/enrich_references | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v8 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v9 |
| ef:activity/change/20260821T1302361922970000/249850 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v9 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v10 |
| ef:activity/change/20260821T1302361922970000/255075 | altLabel | ef:agent/chebi_altlabels | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v10 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v11 |
| ef:activity/change/20260821T1302361922970000/261632 | prefLabel | ef:agent/consensus_match | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v11 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v12 |
| ef:activity/change/20260821T1302361922970000/261633 | altLabel | ef:agent/consensus_match | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v12 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v13 |
| ef:activity/change/20260821T1302361922970000/261634 | altLabel | ef:agent/consensus_match | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v13 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v14 |
| ef:activity/change/20260821T1302361922970000/261635 | cas_match_labels | ef:agent/consensus_match | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v14 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v15 |
| ef:activity/change/20260821T1302361922970000/274989 | properties | ef:agent/opsin_iupac | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v15 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v16 |
| ef:activity/change/20260821T1302361922970000/281473 | properties | ef:agent/rdkit_post_consensus | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v16 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v17 |
| ef:activity/change/20260821T1302361922970000/288384 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v17 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v18 |
| ef:activity/change/20260821T1302361922970000/323162 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v18 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v19 |
| ef:activity/change/20260821T1302361922970000/389297 | properties | ef:agent/normalise_property_values | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v19 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v20 |
| ef:activity/change/20260821T1302361922970000/396382 | types | ef:agent/link_flows_to_their_substance | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v20 | ef:flow/4863bd5f-d194-498e-a832-5b419aeddda6/v21 |